SCHEMBL8472140

SCHEMBL8472140

CCc1ccc(N2CCNC2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.46
ALDH1A1 P00352 3/20 0.45
POLB P06746 3/20 0.45
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
CMA1 P23946 2/20 0.39
EGLN1 Q9GZT9 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HCAR1 Q9BXC0 1/20 0.38

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
SCHEMBL2307893 0.84 GAA (0.45) ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL27986704 0.83 POLB (0.42) ALDH1A1POLBLMNASMN1; SMN2MEN1
SCHEMBL2357330 0.83 ALDH1A1 (0.61) ALDH1A1LMNAMEN1KMT2A
SCHEMBL14365562 0.82 POLB (0.45) ALDH1A1POLBLMNASMN1; SMN2MEN1
SCHEMBL15491149 0.81 NCF1 (0.44) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL24720995 0.81 BCL2 (0.47) MGLLPOLBLMNAMEN1KMT2A
SCHEMBL2883318 0.79 ADRB1 (0.47) MGLLPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL5727688 0.78 POLB (0.47) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL8607864 0.78 ALDH1A1 (0.41) ALDH1A1POLBLMNASMN1; SMN2MEN1
SCHEMBL11919043 0.78 SLC6A2 (0.46) MGLLALDH1A1POLBSMN1; SMN2MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400504-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Center for Excellence in Molecular Cell Science, Chinese Academy of Sciences (CN) 2024-07-17 EP disclosed
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SOUTHERN RESEARCH INSTITUTE 2023-06-22 US disclosed
US-9078909-B2 Tertiary amines, medicaments containing said amines, use thereof and processes for the preparation thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-07-14 US disclosed
US-5990139-A 2,5-DIOXO-4-(PYRIDYL OR PHENYL-(N-HETEROCYCLE(C4N,C3N2))-ALKYLENOXY-(1,4-PHENYLENE) -)THIADIAZOLIDINES; ANTIDIABETIC AND -LIPEMIC AGENTS; SIDE EFFECT REDUCTION TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-11-23 US 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 (1 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-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SARS1, ACE2, ACE MGLL 1020/4885ALDH1A1 4373/4885POLB 3538/4885

“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.