SCHEMBL17954153

SCHEMBL17954153

Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.68
GPR183 P32249 5/20 0.62
AKR1C3 P42330 4/20 0.58
KDM4E B2RXH2 1/20 0.57
MAPT P10636 1/20 0.57
HDAC6 Q9UBN7 1/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
DRD3 P35462 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
SCHEMBL16598965 0.91 HRH4 (0.66) HRH4GPR183KDM4EMAPTHDAC6
SCHEMBL17954152 0.88 HRH4 (0.63) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17954150 0.88 HRH4 (0.63) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17954133 0.88 AKR1C3 (0.73) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17938686 0.87 GPR183 (0.80) HRH4GPR183KDM4EMAPTHDAC6
SCHEMBL16598772 0.87 AKR1C3 (0.65) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17938627 0.87 HRH4 (0.66) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17954149 0.86 HRH4 (0.63) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17954151 0.86 HRH4 (0.63) HRH4GPR183AKR1C3KDM4EMAPT
SCHEMBL17954179 0.86 HRH4 (0.75) HRH4GPR183AKR1C3MEN1KMT2A

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 3590/4885GPR183 22/4885AKR1C3 3119/4885

“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.