SCHEMBL25681998

SCHEMBL25681998

CCCCc1ccc2c(c1)oc1c2ccc2c1c1ccccc1n2C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ SLC2A1 P11166 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ UTS2R Q9UKP6 1/20 0.40
▸ RORA P35398 2/20 0.39
▸ RORC P51449 2/20 0.39
▸ RORB Q92753 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HSD11B1 P28845 1/20 0.35
▸ CYP2C19 P33261 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
SCHEMBL25682860 0.94 ALDH1A1 (0.39) KDM4EHTTUTS2RRORARORC
SCHEMBL25996887 0.91 CYP1A2 (0.43) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25682837 0.86 CYP1A2 (0.39) KDM4ECYP1A2CYP2D6HTTUTS2R
SCHEMBL25683407 0.86 HPGD (0.40) KDM4ECYP1A2CYP2D6SMN1; SMN2UTS2R
SCHEMBL25997036 0.85 KDM4E (0.41) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25683374 0.84 CYP1A2 (0.40) KDM4ECYP1A2CYP2D6SMN1; SMN2RORA
SCHEMBL25682096 0.81 KDM4E (0.43) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25683150 0.81 HPGD (0.39) KDM4ECYP1A2CYP2D6HTTUTS2R
SCHEMBL25996869 0.80 UTS2R (0.40) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL13183691 0.79 GPR3 (0.47) KDM4ECYP1A2CYP2D6HTTUTS2R

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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