SCHEMBL3417792

SCHEMBL3417792

Cc1cc(C(C)N)ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.52
S1PR1 P21453 1/20 0.41
LMNA P02545 3/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
PNMT P11086 2/20 0.38
CD44 P16070 1/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
NFKB1 P19838 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 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
SCHEMBL13075535 1.00 ADRB2 (0.52) ADRB2S1PR1LMNATP53HTT
SCHEMBL8185537 1.00 ADRB2 (0.52) ADRB2S1PR1LMNATP53HTT
Hydrochloric Acid SCHEMBL3715367 0.98 ADRB2 (0.50) ADRB2S1PR1LMNATP53HTT
SCHEMBL2273892 0.83 S1PR1 (0.43) ADRB2S1PR1LMNATP53HTT
SCHEMBL8286723 0.83 ADRB2 (0.52) ADRB2LMNATP53HTTPNMT
SCHEMBL29453111 0.82 ADRB2 (0.56) ADRB2LMNATP53HTTPNMT
SCHEMBL1104688 0.82 LMNA (0.52) S1PR1LMNAHTTAKR1C3AKR1C2
SCHEMBL5862322 0.82 ADRB2 (0.56) ADRB2LMNATP53HTTPNMT
SCHEMBL61975 0.82 ADRB2 (0.56) ADRB2LMNATP53HTTPNMT
SCHEMBL3181409 0.82 ADRB2 (0.56) ADRB2LMNATP53HTTPNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111848494-B Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2023-08-01 CN disclosed
US-10844044-B2 WDR5 inhibitors and modulators VANDERBILT UNIVERSITY (US) 2020-11-24 US disclosed
WO-2020221380-A1 SELECTIVE LIGANDS OF HUMAN CONSTITUTIVE ANDROSTANE RECEPTOR USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V. V. I. (CZ) 2020-11-05 WO disclosed
CN-111848494-A Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2020-10-30 CN disclosed
US-10807959-B2 WDR5-MLL1 inhibitors and modulators VANDERBILT UNIVERSITY (US) 2020-10-20 US disclosed
US-20200102288-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2020-04-02 US disclosed
US-20200055824-A1 WDR5-MLL1 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2020-02-20 US disclosed
US-9365491-B2 Inhibitors of cognitive decline COGNITION THERAPEUTICS, INC. (US) 2016-06-14 US disclosed
US-8921405-B2 Compounds OREXO AB (SE) 2014-12-30 US disclosed
US-20140371324-A1 INHIBITORS OF COGNITIVE DECLINE COGNITION THERAPEUTICS, INC. (US) 2014-12-18 US disclosed
US-20120095105-A1 INHIBITORS OF COGNITIVE DECLINE COGNITION THERAPEUTICS, INC. (US) 2012-04-19 US disclosed
EP-1222178-A1 ALKYL-AMINO-1,3,5-TRIAZINES AND THEIR USE AS HERBICIDES Aventis CropScience GmbH (DE) 2002-07-17 EP disclosed
WO-2001027093-A1 ALKYL-AMINO-1,3,5-TRIAZINES AND THEIR USE AS HERBICIDES AVENTIS CROPSCIENCE GMBH (DE) 2001-04-19 WO disclosed
US-6093851-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-07-25 US disclosed
EP-0735018-B1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL CO (JP) 1999-07-21 EP disclosed
US-5739401-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-14 US disclosed
EP-0735018-A1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed
EP-0191496-B1 TRIAZINE DERIVATIVES, A PROCESS FOR PREPARING THE DERIVATIVES, AND HERBICIDES CONTAINING THE DERIVATIVES AS THE EFFECTIVE COMPONENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-10-31 EP disclosed
US-4680054-A Triazine derivatives, a process for preparing the derivatives, and herbicides containing the derivatives as the effective component IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-07-14 US disclosed
EP-0191496-A2 Triazine Derivatives, a process for preparing the derivatives, and herbicides containing the derivatives as the effective component IDEMITSU KOSAN COMPANY LIMITED (JP) 1986-08-20 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 (6 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-20200102288-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 ADRB2 4754/4885S1PR1 3779/4885LMNA 2317/4885
US-20120095105-A1 INHIBITORS OF COGNITIVE DECLINE PSEN2, ACHE, MAPT ADRB2 508/4885S1PR1 1411/4885LMNA 3447/4885
US-20140371324-A1 INHIBITORS OF COGNITIVE DECLINE PSEN2, ACHE, MAPT ADRB2 508/4885S1PR1 1411/4885LMNA 3447/4885
US-10844044-B2 WDR5 inhibitors and modulators WDR5, WDR1, WDR3 ADRB2 4707/4885S1PR1 3691/4885LMNA 2328/4885
US-10807959-B2 WDR5-MLL1 inhibitors and modulators WDR5, WDR1, WDR3 ADRB2 4745/4885S1PR1 2610/4885LMNA 2165/4885
US-20200055824-A1 WDR5-MLL1 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 ADRB2 4745/4885S1PR1 2610/4885LMNA 2165/4885

“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.