SCHEMBL25775109

SCHEMBL25775109

Cc1cc(-c2ccc3ccccc3c2)c2oc3ccccc3c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.46
▸ CYP1A2 P05177 4/20 0.42
▸ CYP2C9 P11712 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ GSTP1 P09211 1/20 0.40
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ PRKDC P78527 1/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MAOB P27338 2/20 0.38
▸ TNKS O95271 1/20 0.38
▸ PARP1 P09874 1/20 0.38

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
SCHEMBL17851236 0.85 ALOX5 (0.48) ALOX5CYP1A2ALDH1A1CYP3A4HPGD
SCHEMBL12799818 0.85 ALOX5 (0.50) ALOX5ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL24502151 0.83 ALOX5 (0.44) ALOX5CYP1A2CYP2C9ALDH1A1CYP3A4
SCHEMBL19011016 0.83 NUDT1 (0.48) ALOX5CYP1A2ALDH1A1CYP3A4HPGD
SCHEMBL25762959 0.83 ALOX5 (0.46) ALOX5CYP1A2CYP2C9GSTP1CYP1A1
SCHEMBL12799821 0.83 ALOX5 (0.46) ALOX5ALDH1A1CYP3A4HPGDTSHR
SCHEMBL12799826 0.82 ALOX5 (0.48) ALOX5ALDH1A1CYP3A4HPGDTSHR
SCHEMBL18086162 0.82 ALOX5 (0.66) ALOX5CYP1A2CYP2C9GSTP1CYP1A1
SCHEMBL19521826 0.81 ALOX5 (0.57) ALOX5ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL25118713 0.81 ALOX5 (0.64) ALOX5CYP1A2CYP2C9GSTP1CYP1A1

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
US-20230301189-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-09-21 — — US disclosed
US-20230200227-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-06-22 — — US disclosed
US-20230200227-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-06-22 — — US disclosed
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