SCHEMBL7974649

SCHEMBL7974649

O=C1N(c2ccccc2)CCN1c1cc2cc(Cl)ccc2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
DAO P14920 1/20 0.46
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
CYP19A1 P11511 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADORA3 P0DMS8 1/20 0.41
GRIN1 Q05586 2/20 0.40
ROCK2 O75116 2/20 0.40
MAP4K4 O95819 1/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40
PIM1 P11309 1/20 0.40
RPS6KB1 P23443 1/20 0.40
CDK2 P24941 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
SCHEMBL7979410 0.88 DAO (0.44) MEN1KMT2ANPC1RAB9ADAO
SCHEMBL3791087 0.75 NPC1 (0.47) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL6400106 0.74 HRH4 (0.55) MEN1KMT2ANPC1RAB9AF7
SCHEMBL7969172 0.72 NPC1 (0.53) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL10140203 0.71 MAT2A (0.44) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL6400290 0.69 HRH4 (0.53) MEN1KMT2ANPC1RAB9AF7
SCHEMBL610584 0.69 NPC1 (1.00) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL27929042 0.68 SRD5A1 (0.41) MEN1KMT2ANPC1RAB9ADAO
SCHEMBL10980382 0.68 KMT2A (0.61) MEN1KMT2ANPC1RAB9ADAO
SCHEMBL31378871 0.67 DAO (0.64) MEN1KMT2ANPC1RAB9ADAO

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
EP-2805939-B1 Heterocyclic compounds as factor IXA inhibitors. MERCK SHARP & DOHME (US) 2018-06-27 EP disclosed
EP-2805939-A1 Heterocyclic compounds as factor IXA inhibitors. Merck Sharp & Dohme Corp. (US) 2014-11-26 EP disclosed
US-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
WO-2009143039-A2 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS SCHERING CORPORATION (US) 2009-11-26 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-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS F9, F12, F8 MEN1 994/4885KMT2A 2422/4885NPC1 1029/4885

“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.