SCHEMBL13680451

SCHEMBL13680451

Cc1ccc(-c2cccc(Cl)c2)o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.58
S1PR4 O95977 1/20 0.51
MAPT P10636 7/20 0.50
KMT2A Q03164 4/20 0.50
KDM4E B2RXH2 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
GAA P10253 2/20 0.50
APAF1 O14727 1/20 0.50
THRB P10828 1/20 0.50
GALK1 P51570 1/20 0.50
BLM P54132 1/20 0.50
ALDH1A1 P00352 6/20 0.49
HPGD P15428 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
POLB P06746 3/20 0.49
MEN1 O00255 3/20 0.49
ALOX15 P16050 2/20 0.49
HTT P42858 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MITF O75030 1/20 0.49

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
SCHEMBL14363045 0.82 CD274 (0.53) SOS1MAPTKMT2AKDM4ETDP1
SCHEMBL29962351 0.80 SOS1 (0.57) SOS1S1PR4MAPTKMT2AKDM4E
SCHEMBL28879185 0.80 SOS1 (0.57) SOS1S1PR4MAPTKMT2AKDM4E
SCHEMBL12266933 0.80 SLC9A1 (0.50) MAPTKMT2AKDM4ETDP1ALDH1A1
SCHEMBL18551807 0.78 PTGS1 (0.47) MAPTKMT2AKDM4EGAAALDH1A1
SCHEMBL19788209 0.78 SOS1 (0.59) SOS1S1PR4MAPTKMT2AKDM4E
SCHEMBL10000785 0.78 SOS1 (0.69) SOS1S1PR4MAPTKMT2AKDM4E
SCHEMBL4447984 0.77 HSD17B1 (0.49) MAPTKMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL5545324 0.77 NR4A1 (0.56) MAPTKMT2AKDM4EGAAALDH1A1
SCHEMBL1351745 0.77 ALDH1A1 (0.59) MAPTKMT2AKDM4EGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9872911-B2 Alpha-aminoamidine polymers and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-01-23 US disclosed
WO-2017106552-A1 POTENTIATORS OF BETA-LACTAM ANTIBIOTICS AND COMBINATION THERAPY UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-06-22 WO disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
EP-1905762-A1 PYRAZOLONE DERIVATIVE Genecare Research Institute Co., Ltd (JP) 2008-04-02 EP disclosed
EP-1900728-A1 PHARMACEUTICAL COMPOSITION COMPRISING PYRAZOLONE DERIVATIVE Genecare Research Institute Co., Ltd (JP) 2008-03-19 EP disclosed
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 SOS1 1207/4885S1PR4 3974/4885MAPT 4163/4885

“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.