SCHEMBL812121

SCHEMBL812121

CN(C)C1CCCCC1NC(=S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 8/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.40
MYC P01106 1/20 0.40
MAX P61244 1/20 0.40
POLB P06746 2/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 3/20 0.38
ALOX12 P18054 1/20 0.38
P2RX4 Q99571 1/20 0.36
P2RX7 Q99572 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26216793 1.00 LMNA (0.49) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL812122 1.00 LMNA (0.49) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL12997180 1.00 LMNA (0.49) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL2513150 1.00 LMNA (0.49) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL19979000 0.93 LMNA (0.46) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL12660185 0.93 LMNA (0.46) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL2623072 0.93 LMNA (0.46) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL17466653 0.93 LMNA (0.46) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL13038442 0.90 LMNA (0.43) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL4300748 0.89 LMNA (0.46) LMNAMEN1KMT2AHTTSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7632970-B2 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-15 US claimed
US-20240257921-A1 COMPUTATIONAL GENERATION OF CHEMICAL SYNTHESIS ROUTES AND METHODS STANFORD RES INST INT (US) 2024-08-01 US disclosed
US-11961595-B2 Computational generation of chemical synthesis routes and methods SRI INTERNATIONAL (US) 2024-04-16 US disclosed
US-11840604-B2 Process for preparation of block copolymer LG CHEM, LTD. (KR) 2023-12-12 US disclosed
US-11827745-B2 Triblock copolymer and process for preparation thereof LG CHEM, LTD. (KR) 2023-11-28 US disclosed
WO-2023107419-A1 SATURATED SPIROCYCLICS AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2023-06-15 WO disclosed
US-20230123848-A1 POLYLACTATE STEREOCOMPLEX AND PREPARATION METHOD THEREOF LG CHEM, LTD. (KR) 2023-04-20 US disclosed
CN-109715633-B Dopamine-beta-hydroxylase inhibitors 巴尔-波特拉及康邦亚股份有限公司 2022-03-04 CN disclosed
US-20220017523-A1 BLOOD-BRAIN BARRIER-PENETRANT DOPAMINE-ß-HYDROXYLASE INHIBITORS BIAL - PORTELA & CA, S.A. (PT) 2022-01-20 US disclosed
US-20210340314-A1 TRIBLOCK COPOLYMER AND PROCESS FOR PREPARATION THEREOF LG CHEM, LTD. (KR) 2021-11-04 US disclosed
EP-2345634-B1 Optically active 4-amino-3-(4-chlorophenyl) butanoic acid SUMITOMO CHEMICAL CO (JP) 2013-03-06 EP disclosed
EP-2345634-A1 Optically active 4-amino-3-(4-chlorophenyl) butanoic acid Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110152572-A1 OPTICALLY ACTIVE 4-AMINO-3-(4-CHLOROPHENYL)BUTANOIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED 2011-06-23 US disclosed
US-20110087049-A1 METHOD OF PRODUCING PURIFIED OPTICALLY ACITVE 4-AMINO-3-(SUBSTITUTED PHENYL)BUTANOIC ACID COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED 2011-04-14 US disclosed
EP-2298730-A1 METHOD OF PRODUCING PURIFIED OPTICALLY ACTIVE 4-AMINO-3-(SUBSTITUTED PHENYL)BUTANOIC ACID COMPOUND Sumitomo Chemical Company, Limited (JP) 2011-03-23 EP disclosed
US-7655817-B2 Reacting an azo compound and a compound having an electron-withdrawing group attached to a monohydrogenated carbon using a nonmetal, optically active urea or thiourea catalyst to obtain the hydrazine; reducing to the amine; efficiency;stereospecific; drug product having alpha-amino structure KYOTO UNIVERSITY (JP) 2010-02-02 US disclosed
US-7632970-B2 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-15 US disclosed
US-20060194986-A1 Production methods of optically active hydrazine compound and optically active amine compound KYOTO UNIVERSITY SUMITOMO CHEMICAL COMPANY, LIMITED 2006-08-31 US disclosed
US-20060161006-A1 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-20 US disclosed
EP-1640361-A2 ASYMMETRIC UREA COMPOUND AND PROCESS FOR PRODUCING ASYMMETRIC COMPOUND BY ASYMMETRIC CONJUGATE ADDITION REACTION WITH THE SAME AS CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-03-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220017523-A1 BLOOD-BRAIN BARRIER-PENETRANT DOPAMINE-ß-HYDROXYLASE INHIBITORS DBH, SLC6A3, SLC6A2 LMNA 2604/4885MEN1 2536/4885KMT2A 2842/4885
US-20110087049-A1 METHOD OF PRODUCING PURIFIED OPTICALLY ACITVE 4-AMINO-3-(SUBSTITUTED PHENYL)BUTANOIC ACID COMPOUND ALAD, OR10J3, ACMSD LMNA 3798/4885MEN1 3836/4885KMT2A 3807/4885
US-20060161006-A1 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst RAD18, UTP18, UBE2G2 LMNA 4526/4885MEN1 2949/4885KMT2A 1137/4885
US-20060194986-A1 Production methods of optically active hydrazine compound and optically active amine compound H1-0, H1-5, H1-10 LMNA 2404/4885MEN1 3387/4885KMT2A 723/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.