SCHEMBL28566115

SCHEMBL28566115

COc1ccc2c(=O)c(-c3ccccc3)c(-c3ccccc3)oc2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.76
▸ KDM4E B2RXH2 5/20 0.76
▸ MAPT P10636 5/20 0.76
▸ CYP3A4 P08684 4/20 0.76
▸ HPGD P15428 4/20 0.76
▸ MEN1 O00255 3/20 0.76
▸ KMT2A Q03164 3/20 0.76
▸ HSD17B10 Q99714 3/20 0.76
▸ CYP2C9 P11712 3/20 0.76
▸ CYP2C19 P33261 3/20 0.76
▸ CYP1A2 P05177 2/20 0.76
▸ THRB P10828 1/20 0.76
▸ CA1 P00915 3/20 0.74
▸ CA2 P00918 3/20 0.74
▸ TP53 P04637 2/20 0.61
▸ NPC1 O15118 2/20 0.61
▸ RAB9A P51151 2/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ CASP1 P29466 1/20 0.61
▸ CASP7 P55210 1/20 0.61

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
SCHEMBL29768227 1.00 ALDH1A1 (0.76) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL3204569 0.86 ALDH1A1 (1.00) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL27726517 0.86 ALDH1A1 (0.76) ALDH1A1KDM4EMAPTCYP3A4HPGD
3,7-Dimethoxyflavone SCHEMBL4278796 0.86 ALDH1A1 (1.00) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL1534530 0.86 CA1 (0.59) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL4650060 0.85 KDM4E (0.85) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL15676588 0.85 KDM4E (0.85) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL1534565 0.85 ALDH1A1 (0.74) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL7155818 0.85 ALDH1A1 (0.74) ALDH1A1KDM4EMAPTCYP3A4HPGD
SCHEMBL11550681 0.83 ALDH1A1 (0.70) ALDH1A1KDM4EMAPTCYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220264919-A1 PREPARATION METHOD OF DRIED SCALLOP ZHEJIANG OCEAN UNIVERSITY (CN) 2022-08-25 — — US disclosed
WO-2022151514-A1 DRIED SCALLOP FLAVOR DETECTION AND EVALUATION METHOD 浙江海洋大学 2022-07-21 — — WO disclosed
CN-112772879-B Preparation method of dried scallop 浙江海洋大学 2022-05-06 — — CN disclosed
CN-112881549-A Detection and evaluation method for flavor of dried scallop 浙江海洋大学 2021-06-01 — — CN disclosed
CN-112772879-A Preparation method of dried scallop 浙江海洋大学 2021-05-11 — — CN disclosed
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