SCHEMBL22434752

SCHEMBL22434752

Cc1ccc(F)c2cc(C)n(C)c12

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.36
FTO Q9C0B1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HRH4 Q9H3N8 1/20 0.34
GRM4 Q14833 1/20 0.33
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
HCRTR1 O43613 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 1/20 0.30
PGR P06401 1/20 0.30
AR P10275 1/20 0.30

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
SCHEMBL22434755 0.88 CASP1 (0.33) CASP1CASP7HSD17B10KMT2A
SCHEMBL22434864 0.86 PARP15 (0.33) KDM4EMAPTHRH4CASP1CASP7
SCHEMBL22434751 0.85 ALKBH5 (0.42) ALKBH5FTOKDM4EMAPTCASP1
SCHEMBL22434747 0.81 HSD11B1 (0.36) MAPT
SCHEMBL22434778 0.78 CYP19A1 (0.44) KDM4EMAPTGRM4RAB9A
SCHEMBL22434878 0.77 TRPV4 (0.37) KDM4EMEN1KMT2APGRAR
SCHEMBL22434862 0.73
SCHEMBL22434672 0.73
SCHEMBL23714593 0.73 JAK2 (0.38) MAPT
SCHEMBL22434773 0.73 CYP19A1 (0.45) ALKBH5FTOKDM4EMAPTNPC1

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-11241431-B2 N-substituted indole derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2022-02-08 US disclosed
US-20200289507-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2020-09-17 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 (2 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-20200289507-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS PGE2 RECEPTOR MODULATORS PTGER1, PTGER4, PTGER2 ALKBH5 3212/4885FTO 4397/4885KDM4E 2755/4885
US-11241431-B2 N-substituted indole derivatives as PGE2 receptor modulators PTGER1, PTGER4, PTGER2 ALKBH5 3212/4885FTO 4397/4885KDM4E 2755/4885

“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.