SCHEMBL18002604

SCHEMBL18002604

O=Cc1cc(Cl)cc(OCc2cc(C(F)(F)F)ccc2C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 1/20 0.50
▸ SRD5A1 P18405 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ AHR P35869 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ NR1H2 P55055 3/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP26A1 O43174 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ AR P10275 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL18003240 0.90 SLC6A4 (0.45) SRD5A2SRD5A1L3MBTL1TDP1AHR
SCHEMBL16399110 0.89 SRD5A2 (0.53) SRD5A2SRD5A1L3MBTL1POLBALDH1A1
SCHEMBL18003237 0.85 IDO1 (0.47) L3MBTL1TDP1AHRPOLBALDH1A1
SCHEMBL18002415 0.85 SRD5A2 (0.42) SRD5A2SRD5A1L3MBTL1TDP1POLB
SCHEMBL18002464 0.85 SRD5A2 (0.50) SRD5A2SRD5A1L3MBTL1POLBALDH1A1
SCHEMBL18002186 0.85 SRD5A2 (0.50) SRD5A2SRD5A1L3MBTL1POLBALDH1A1
SCHEMBL16399166 0.85 SRD5A2 (0.50) SRD5A2SRD5A1L3MBTL1TDP1POLB
SCHEMBL18002335 0.85 SRD5A2 (0.50) SRD5A2SRD5A1L3MBTL1POLBALDH1A1
SCHEMBL18002674 0.83 SRD5A2 (0.48) SRD5A2SRD5A1L3MBTL1POLBALDH1A1
SCHEMBL12577906 0.83 SRD5A2 (0.62) SRD5A2SRD5A1L3MBTL1POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 SRD5A2 937/4885SRD5A1 764/4885L3MBTL1 1503/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 SRD5A2 937/4885SRD5A1 764/4885L3MBTL1 1503/4885

“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.

Send feedback