SCHEMBL17954151

SCHEMBL17954151

Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(C(F)(F)F)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 4/20 0.63
AKR1C3 P42330 6/20 0.57
GPR183 P32249 3/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
DRD3 P35462 2/20 0.49
POLB P06746 1/20 0.46
DRD2 P14416 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL17954149 0.91 HRH4 (0.63) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL17954143 0.90 KMT2A (0.58) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL16598475 0.90 GPR183 (0.67) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL17954153 0.86 HRH4 (0.68) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL17954152 0.83 HRH4 (0.63) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL16598983 0.83 HRH4 (0.62) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL16598709 0.82 KMT2A (0.62) HRH4GPR183MEN1KMT2ADRD3
SCHEMBL17954150 0.81 HRH4 (0.63) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL17954179 0.81 HRH4 (0.75) HRH4AKR1C3GPR183MEN1KMT2A
SCHEMBL17954176 0.81 HRH4 (0.68) HRH4AKR1C3GPR183MEN1KMT2A

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 3590/4885AKR1C3 3119/4885GPR183 22/4885

“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.