SCHEMBL8346377

SCHEMBL8346377

Cc1cccc(-c2csnn2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
POLB P06746 1/20 0.61
NOTUM Q6P988 1/20 0.61
RAB9A P51151 7/20 0.56
NPC1 O15118 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MEN1 O00255 2/20 0.56
ALDH1A1 P00352 3/20 0.54
HPGD P15428 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
IDO1 P14902 1/20 0.46
METAP2 P50579 1/20 0.46
ATP4A P20648 2/20 0.44
ATP4B P51164 2/20 0.44
TSHR P16473 1/20 0.43
MAPT P10636 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL29683694 0.78 KMT2A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL4750607 0.78 KMT2A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL28571840 0.78 KMT2A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL16636188 0.78 KMT2A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL28615179 0.78 RAB9A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL5547686 0.78 RAB9A (0.56) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL6153838 0.76 KMT2A (1.00) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL69349 0.76 KMT2A (0.91) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL28629357 0.76 KMT2A (0.63) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL5187763 0.74 RAB9A (0.51) KMT2APOLBNOTUMRAB9ANPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275026-A1 Benzamide derivatives as oxytocin agonists and vasopressin antagonists FERRING B.V. 2008-11-06 US disclosed
US-20080275026-A1 Benzamide derivatives as oxytocin agonists and vasopressin antagonists FERRING B.V. 2008-11-06 US disclosed
US-7407949-B2 Benzamide derivatives as oxytocin agonists and vasopressin antagonists FERRING B.V. (NL) 2008-08-05 US disclosed
US-7407949-B2 Benzamide derivatives as oxytocin agonists and vasopressin antagonists FERRING B.V. (NL) 2008-08-05 US disclosed
WO-2004072083-A1 BENZAMIDE DERIVATIVES AS OXYTOCIN AGONISTS AND VASOPRESSIN ANTAGONISTS FERRING B.V. (NL) 2004-08-26 WO disclosed
WO-2003016316-A1 DIAZACYCLOALKANES AS OXYTOCIN AGONISTS FERRING B.V. (NL) 2003-02-27 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-20080275026-A1 Benzamide derivatives as oxytocin agonists and vasopressin antagonists AVPR1A, AVPR2, AVPR1B KMT2A 1922/4885POLB 3258/4885NOTUM 3549/4885

“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.