SCHEMBL2687130

SCHEMBL2687130

CC(=O)Nc1ccc(-c2nc3cc(-c4nc5cc(Cl)ccc5o4)ccc3n2C2CCOCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.61
NPC1 O15118 4/20 0.61
RAB9A P51151 4/20 0.61
SENP7 Q9BQF6 3/20 0.61
POLB P06746 3/20 0.61
TDP1 Q9NUW8 1/20 0.61
THRB P10828 3/20 0.53
LMNA P02545 1/20 0.53
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 2/20 0.51
HPGD P15428 2/20 0.51
PARP3 Q9Y6F1 2/20 0.51
ALDH1A1 P00352 2/20 0.51
RPS6KB1 P23443 1/20 0.47
TP53 P04637 1/20 0.46
UTRN P46939 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
USP2 O75604 1/20 0.45

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
SCHEMBL2688580 0.92 KDM4E (0.54) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2687597 0.87 RPS6KB1 (0.47) CASP3NPC1RAB9ASENP7POLB
SCHEMBL10219866 0.86 HPSE (0.45) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2689825 0.83 PARP3 (0.42) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2687516 0.83 CASP3 (0.48) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2687370 0.83 RPS6KB1 (0.45) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2686940 0.82 KDM4E (0.51) CASP3NPC1RAB9ASENP7POLB
SCHEMBL10219827 0.82 HPSE (0.49) CASP3NPC1RAB9ASENP7POLB
SCHEMBL2686059 0.80 OPRM1 (0.43) CASP3NPC1RAB9ASENP7KDM4E
SCHEMBL2245090 0.78 CASP3 (1.00) CASP3NPC1RAB9ASENP7POLB

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-8829035-B2 Agent for treatment or prevention of diseases associated with activity of neurotrophic factors SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-09 US disclosed
US-8829035-B2 Agent for treatment or prevention of diseases associated with activity of neurotrophic factors SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-09 US disclosed
US-8829035-B2 Agent for treatment or prevention of diseases associated with activity of neurotrophic factors SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-09 US disclosed
EP-2436683-B1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS SUMITOMO CHEMICAL CO (JP) 2014-05-14 EP disclosed
US-20120115856-A1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-10 US disclosed
US-20120115856-A1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-10 US disclosed
US-20120115856-A1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-10 US disclosed
WO-2010137349-A1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS 住友化学株式会社 (JP) 2010-12-02 WO 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-20120115856-A1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS BDNF, NGF, NTRK2 CASP3 1060/4885NPC1 525/4885RAB9A 2914/4885

“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.