SCHEMBL2686813

SCHEMBL2686813

Cc1nc2cc(-c3nc4ccccc4o3)ccc2n1CC(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.45
▸ NPC1 O15118 5/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ HCRTR1 O43613 2/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ STAT1 P42224 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ HSD17B10 Q99714 5/20 0.44
▸ USP2 O75604 4/20 0.44
▸ TSHR P16473 4/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44

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
SCHEMBL10219903 0.87 APAF1 (0.63) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2688340 0.86 KDM4E (0.43) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2687383 0.85 KDM4E (0.55) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2688624 0.84 KMT2A (0.53) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2686523 0.83 KDM4E (0.48) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2687903 0.82 APAF1 (0.46) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2687137 0.82 KDM4E (0.46) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2687042 0.82 NPC1 (0.46) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2687478 0.82 TNF (0.58) KDM4EALDH1A1RAB9AMAPTMEN1
SCHEMBL10219624 0.82 NPC1 (0.49) KDM4ENPC1ALDH1A1SMN1; SMN2HPGD

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 KDM4E 4538/4885NPC1 525/4885ALDH1A1 1772/4885

“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.

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