SCHEMBL29043370

SCHEMBL29043370

Cc1cc(O)c(C(C)(C)CC(C)(C)C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 7/20 0.41
ALOX15 P16050 6/20 0.41
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
HIF1A Q16665 4/20 0.41
TP53 P04637 4/20 0.41
MAPK1 P28482 3/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SHBG P04278 1/20 0.41
MAPT P10636 3/20 0.39
CYP1A2 P05177 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ATP2A2 P16615 1/20 0.39
ATP2A3 Q93084 1/20 0.39
CYP2C9 P11712 4/20 0.39
CYP2D6 P10635 3/20 0.39
CYP2C19 P33261 3/20 0.39
ESR1 P03372 4/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL31108087 0.90 ALOX15 (0.40) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL127401 0.90 ALOX15 (0.43) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL126587 0.87 ALOX15 (0.52) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL9351484 0.86 ALDH1A1 (0.46) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL31108072 0.86 ALDH1A1 (0.46) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL9745046 0.83 ALOX15 (0.56) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL2481099 0.83 ALOX15 (0.66) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL28612138 0.83 SHBG (0.41) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL9311748 0.83 ALOX15 (0.48) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A
SCHEMBL31108088 0.82 ALDH1A1 (0.50) CYP3A4ALOX15ALDH1A1SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283503-B Method for separating phenol monomer from mixed phenol 煤炭科学技术研究院有限公司 2025-03-28 CN claimed
CN-116283503-A Method for separating phenol monomer from mixed phenol 煤炭科学技术研究院有限公司 2023-06-23 CN claimed
CN-116283503-B Method for separating phenol monomer from mixed phenol 煤炭科学技术研究院有限公司 2025-03-28 CN disclosed
CN-116283503-A Method for separating phenol monomer from mixed phenol 煤炭科学技术研究院有限公司 2023-06-23 CN disclosed