SCHEMBL25640366

SCHEMBL25640366

c1ccc(N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccc3sc4ccc5c6cc7ccccc7cc6oc5c4c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ S1PR4 O95977 8/20 0.33
▸ S1PR5 Q9H228 8/20 0.33
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1B1 Q16678 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
SCHEMBL25640310 0.98 S1PR4 (0.33) S1PR4S1PR5CYP1A1CYP1B1
SCHEMBL25640314 0.95 — —
SCHEMBL25640613 0.94 S1PR4 (0.33) S1PR4S1PR5CYP1A1CYP1B1
SCHEMBL25640365 0.94 — —
SCHEMBL25640364 0.93 ESR2 (0.30) —
SCHEMBL25640571 0.92 S1PR4 (0.33) S1PR4S1PR5CYP1A1CYP1B1
SCHEMBL25640357 0.91 MMP12 (0.32) —
SCHEMBL25640272 0.90 — —
SCHEMBL25640204 0.89 CYP1A1 (0.34) S1PR4S1PR5CYP1A1CYP1B1
SCHEMBL25640342 0.89 ESR2 (0.32) —

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
WO-2023113334-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-06-22 — — WO disclosed
Send feedback