SCHEMBL21945004

SCHEMBL21945004

CC1C=C(c2cccc(OCc3cc(C(F)(F)F)ccc3C(F)(F)F)c2)SC1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 1/20 0.43
▸ SRD5A1 P18405 1/20 0.41
▸ NR1H2 P55055 6/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ MAOB P27338 2/20 0.38
▸ NR4A2 P43354 1/20 0.36
▸ FFAR1 O14842 4/20 0.35
▸ CYP26A1 O43174 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ PTGES O14684 1/20 0.35

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
SCHEMBL21945001 0.89 SRD5A2 (0.50) SRD5A2SRD5A1NR1H2NR1H3MAOB
SCHEMBL21944801 0.84 MAOB (0.43) MAOBNR4A2FFAR1
SCHEMBL21945003 0.72 SRD5A2 (0.47) SRD5A2SRD5A1NR1H2NR1H3MAOB
SCHEMBL18002342 0.72 SRD5A2 (0.45) SRD5A2SRD5A1NR1H2NR1H3MAOB
SCHEMBL21944880 0.72 PPARD (0.43) MAOBNR4A2FFAR1
SCHEMBL16399041 0.71 SRD5A2 (0.43) SRD5A2SRD5A1NR1H2NR1H3MCL1
SCHEMBL16398920 0.70 NPC1 (0.52) SRD5A2SRD5A1MAOBPTGES
SCHEMBL28876730 0.70 SRD5A2 (0.44) SRD5A2SRD5A1NR1H2NR1H3
SCHEMBL28320545 0.69 IDO1 (0.58) SRD5A2NR1H2
SCHEMBL28320645 0.69 SRD5A2 (0.43) SRD5A2SRD5A1NR1H2NR1H3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 SRD5A2 937/4885SRD5A1 764/4885NR1H2 552/4885

“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.

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