SCHEMBL29013752

SCHEMBL29013752

CO[C]1C=C(C)C(OC)=C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HKDC1 Q2TB90 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TYR P14679 1/20 0.33
▸ ERBB2 P04626 1/20 0.32

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
SCHEMBL11025815 0.70 MAPT (0.50) HKDC1KDM4EMEN1USP2TP53
SCHEMBL27256253 0.59 — —
2,6-Dimethoxyquinone SCHEMBL570683 0.57 HKDC1 (1.00) HKDC1KDM4EMEN1USP2TP53
SCHEMBL197028 0.57 HKDC1 (0.70) HKDC1KDM4EMEN1USP2TP53
SCHEMBL684719 0.57 MAPT (0.73) HKDC1KDM4EMEN1USP2TP53
SCHEMBL18950021 0.56 — —
SCHEMBL3417111 0.55 HKDC1 (0.56) HKDC1KDM4EMEN1USP2TP53
SCHEMBL17581119 0.50 — —
SCHEMBL14754529 0.45 — —
SCHEMBL4797741 0.45 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112300303-B Catalyst system for olefin polymerization and application thereof 中国石油化工股份有限公司 2023-08-15 — — CN disclosed
CN-112300302-B Twelve-membered ring compound and application thereof 中国石油化工股份有限公司 2023-05-09 — — CN disclosed
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