SCHEMBL25276101

SCHEMBL25276101

Clc1ccc2c(c1)sc1ccc3c4ccccc4oc3c12

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 10/20 0.53
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ TNKS O95271 1/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 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
SCHEMBL25279286 0.91 AHR (0.53) AHRKDM4EMAPTTP53ALOX5
SCHEMBL1637446 0.85 GPR3 (0.43) AHRKDM4EMAPTALOX5KMT2A
SCHEMBL25645295 0.84 AHR (0.38) AHRKDM4EMAPTTP53
SCHEMBL25276994 0.83 CYP1A1 (0.44) AHRKDM4EMAPTTP53KMT2A
SCHEMBL16919484 0.83 ALOX5 (0.42) AHRKDM4EMAPTALOX5KMT2A
SCHEMBL24004114 0.79 ALOX5 (0.36) AHRKDM4EMAPTTP53ALOX5
SCHEMBL25645407 0.79 ALOX5 (0.35) AHRKDM4EMAPTALOX5KMT2A
SCHEMBL25733693 0.79 CYP1A1 (0.42) AHRKDM4EMAPTTP53KMT2A
SCHEMBL31282478 0.78 AHR (0.43) AHRALOX5KMT2AMEN1SMN1; SMN2
SCHEMBL20321574 0.77 AHR (0.66) AHRKDM4EMAPTTNKSKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024262869-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-12-26 — — WO disclosed
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
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
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