SCHEMBL2689202

SCHEMBL2689202

Cc1nc2cc(-c3nc4cc([N+](=O)[O-])ccc4o3)ccc2n1C1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.53
MAPT P10636 7/20 0.53
NPC1 O15118 6/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MMP2 P08253 4/20 0.50
MMP9 P14780 4/20 0.50
MMP8 P22894 4/20 0.50
MMP13 P45452 4/20 0.50
ALDH1A1 P00352 1/20 0.50
MCL1 Q07820 1/20 0.50
ATM Q13315 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TP53 P04637 2/20 0.43
THRB P10828 1/20 0.42
USP2 O75604 1/20 0.41
PKM P14618 1/20 0.41
CETP P11597 1/20 0.41
CEPT1 Q9Y6K0 1/20 0.41
HSPD1 P10809 1/20 0.40

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
SCHEMBL2688256 0.93 RAB9A (0.50) RAB9AMAPTNPC1SMN1; SMN2MMP2
SCHEMBL2687278 0.85 KDM4E (0.51) RAB9AMAPTNPC1SMN1; SMN2MMP2
SCHEMBL2686940 0.84 KDM4E (0.51) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL2688684 0.82 MET (0.44) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL10219776 0.82 L3MBTL1 (0.49) MAPTSMN1; SMN2ALDH1A1TP53USP2
SCHEMBL2698006 0.82 L3MBTL1 (0.60) USP2PKM
SCHEMBL2688389 0.82 USP2 (0.47) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL10219658 0.82 USP2 (0.39) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL2687032 0.82 CETP (0.49) USP2PKMCETPCEPT1
SCHEMBL2687040 0.82 MAPT (0.49) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1

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 7 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

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 RAB9A 2914/4885MAPT 2988/4885NPC1 525/4885

“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.