SCHEMBL24171972

SCHEMBL24171972

c1ccc(-c2ccccc2-c2ccccc2-c2cc(-c3ccc4oc5ccccc5c4c3)c3sc4ccccc4c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.43
▸ PRKDC P78527 3/20 0.38
▸ TNKS O95271 1/20 0.38
▸ TNKS2 Q9H2K2 1/20 0.38
▸ MAPT P10636 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.36
▸ PLA2G2A P14555 3/20 0.35
▸ PLA2G4A P47712 3/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 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
SCHEMBL24393839 0.91 ALOX5 (0.43) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL24171066 0.90 PLA2G2A (0.42) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL24172405 0.87 PRKDC (0.45) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL24171337 0.86 PRKDC (0.41) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL19606990 0.85 ALOX5 (0.38) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL20706908 0.84 ALOX5 (0.59) ALOX5PRKDCMAPTNPC1KDM4E
SCHEMBL18252539 0.84 ALOX5 (0.53) ALOX5PRKDCMAPTNPC1KDM4E
SCHEMBL18252558 0.84 ALOX5 (0.53) ALOX5PRKDCMAPTNPC1KDM4E
SCHEMBL24928186 0.84 ALOX5 (0.44) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL19607127 0.84 PLA2G2A (0.38) ALOX5PRKDCTNKSTNKS2MAPT

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
US-20220006029-A1 COMPOSITION FOR OPTOELECTRONIC DEVICE AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2022-01-06 — — US disclosed
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