SCHEMBL2269424

SCHEMBL2269424

O=c1[nH]c2ccccc2c2c1CNCC2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.63
HTR5A P47898 1/20 0.63
NISCH Q9Y2I1 1/20 0.63
NR2E1 Q9Y466 1/20 0.63
TAAR1 Q96RJ0 1/20 0.61
HTR2A P28223 1/20 0.56
HTR2C P28335 1/20 0.56
PARP1 P09874 2/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP1A2 P05177 3/20 0.53
CYP2C19 P33261 3/20 0.53
HPGD P15428 2/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
TNKS O95271 1/20 0.47
GPR3 P46089 1/20 0.47
BLM P54132 1/20 0.47

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
SCHEMBL25911476 0.79 HSD17B10 (0.61) KDM4EPARP1MEN1KMT2ACYP1A2
SCHEMBL30158836 0.79 HSD17B10 (0.61) KDM4EPARP1MEN1KMT2ACYP1A2
SCHEMBL4668622 0.79 MEN1 (0.66) KDM4EPARP1MEN1KMT2ACYP1A2
SCHEMBL30273084 0.79 MEN1 (0.66) KDM4EPARP1MEN1KMT2ACYP1A2
SCHEMBL31164689 0.78 PARP1 (0.51) NISCHPARP1MEN1KMT2ACYP1A2
Tryptoline SCHEMBL171755 0.77 NISCH (1.00) KDM4EHTR5ANISCHNR2E1TAAR1
SCHEMBL169954 0.77 TAAR1 (0.96) KDM4EHTR5ANISCHNR2E1TAAR1
Tryptoline SCHEMBL12190178 0.77 NISCH (1.00) KDM4EHTR5ANISCHNR2E1TAAR1
Tryptoline SCHEMBL29350043 0.77 NISCH (1.00) KDM4EHTR5ANISCHNR2E1TAAR1
Hydrochloric Acid SCHEMBL30293232 0.77 MEN1 (0.64) KDM4EPARP1MEN1KMT2ACYP1A2

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-9255096-B1 Substituted 1,2,3,4-tetrahydrobenzo[C][2,7] naphthyridines and derivatives thereof as kinase inhibitors ALLERGAN, INC. (US) 2016-02-09 US disclosed
US-9255096-B1 Substituted 1,2,3,4-tetrahydrobenzo[C][2,7] naphthyridines and derivatives thereof as kinase inhibitors ALLERGAN, INC. (US) 2016-02-09 US disclosed
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-7994196-B2 Indazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 EP disclosed
US-3991064-A Benzonaphthyridines WARNER-LAMBERT COMPANY (US) 1976-11-09 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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 KDM4E 2565/4885HTR5A 1270/4885NISCH 1131/4885

“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.