SCHEMBL17954172

SCHEMBL17954172

Cc1ccc(OC2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.65
MEN1 O00255 3/20 0.65
RAB9A P51151 2/20 0.65
ATM Q13315 1/20 0.65
HRH3 Q9Y5N1 9/20 0.61
HRH4 Q9H3N8 4/20 0.61
HRH1 P35367 1/20 0.61
AKR1C3 P42330 2/20 0.58
NPC1 O15118 1/20 0.56
POLB P06746 1/20 0.56

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
SCHEMBL16598764 0.93 HRH3 (0.66) KMT2AMEN1RAB9AATMHRH3
SCHEMBL16599041 0.89 GPR183 (0.61) KMT2AMEN1RAB9AATMHRH3
SCHEMBL16599280 0.89 HRH4 (0.63) KMT2AMEN1RAB9AATMHRH3
SCHEMBL1809730 0.87 HRH3 (0.66) KMT2AMEN1HRH3HRH4AKR1C3
SCHEMBL17954171 0.87 KMT2A (0.57) KMT2AMEN1RAB9AATMHRH3
SCHEMBL17938685 0.87 GPR183 (0.61) KMT2AMEN1RAB9AATMHRH3
SCHEMBL17954174 0.87 KMT2A (0.62) KMT2AMEN1RAB9AATMHRH3
SCHEMBL16598954 0.86 KMT2A (0.62) KMT2AMEN1RAB9AATMHRH3
SCHEMBL1808298 0.85 HRH4 (0.58) KMT2AMEN1RAB9AATMHRH3
SCHEMBL1810411 0.84 DRD3 (0.64) HRH3HRH4AKR1C3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9776979-B2 EBI2 modulators SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2017-10-03 US disclosed
US-20160214951-A1 EBI2 MODULATORS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2016-07-28 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-20160214951-A1 EBI2 MODULATORS BIRC2, HAVCR2, MAVS KMT2A 1057/4885MEN1 2201/4885RAB9A 1970/4885

“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.