SCHEMBL17954179

SCHEMBL17954179

Cc1ccc(C(=O)N2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.75
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
AKR1C3 P42330 6/20 0.55
GPR183 P32249 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
HRH3 Q9Y5N1 2/20 0.50

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
SCHEMBL17938681 0.93 HRH4 (0.78) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL17954177 0.91 HRH4 (0.75) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL16598859 0.89 HRH4 (0.71) HRH4MEN1KMT2AGPR183HRH3
SCHEMBL17955276 0.89 HRH4 (0.71) HRH4MEN1KMT2AGPR183HRH3
SCHEMBL16599043 0.87 HRH4 (0.76) HRH4NPC1RAB9AGPR183HRH3
SCHEMBL16598571 0.87 HRH4 (0.69) HRH4GPR183
SCHEMBL17954153 0.86 HRH4 (0.68) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL6141969 0.86 HRH4 (1.00) HRH4HRH3
SCHEMBL16599098 0.86 HRH4 (0.67) HRH4GPR183CYP2C19HRH3
SCHEMBL16598885 0.85 HRH4 (0.73) HRH4MEN1KMT2AGPR183

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 HRH4 3590/4885NPC1 2095/4885RAB9A 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.