SCHEMBL25684157

SCHEMBL25684157

CCCc1ccc2c(c1)c1cc3c(cc1n2Cc1ccc2sc4cc5c(cc4c2c1)c1c(CCC)cccc1n5C)sc1ccccc13

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 7/20 0.35
▸ MAPT P10636 6/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ RORA P35398 2/20 0.34
▸ RORC P51449 2/20 0.34
▸ RORB Q92753 2/20 0.34
▸ HCRTR1 O43613 2/20 0.33
▸ HCRTR2 O43614 2/20 0.33
▸ PGR P06401 2/20 0.31
▸ THRB P10828 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ GLA P06280 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
SCHEMBL25998091 0.86 UTS2R (0.36) MAPTCNR2SMN1; SMN2GLA
SCHEMBL25998067 0.82 RORA (0.40) MAPTSMN1; SMN2RORARORCRORB
SCHEMBL25683588 0.81 GPR3 (0.36) MAPTCNR2SMN1; SMN2
SCHEMBL25682691 0.80 PGR (0.35) TP53MAPTCNR2RORARORC
SCHEMBL25684233 0.80 KDM4E (0.43) MAPTCNR2RORARORCRORB
SCHEMBL25684231 0.78 GPR3 (0.40) MAPTRORCNPSR1
SCHEMBL25683586 0.78 RORA (0.40) MAPTSMN1; SMN2RORARORCRORB
SCHEMBL25997406 0.77 RORA (0.46) MAPTCNR2SMN1; SMN2RORARORC
SCHEMBL25684155 0.77 HPGD (0.45) MAPTSMN1; SMN2RORARORCRORB
SCHEMBL25684237 0.76 HPGD (0.46) MAPTRORARORCRORBNPSR1

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
EP-4190791-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT Kyulux, Inc. (JP) 2023-06-07 — — EP disclosed
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