SCHEMBL30768157

SCHEMBL30768157

Oc1c(-c2cccc3ccccc23)c(-c2cccc3ccccc23)c(-c2cccc3ccccc23)c(-c2cccc3ccccc23)c1-c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.50
▸ PTPN22 Q9Y2R2 1/20 0.46
▸ DHFR P00374 1/20 0.44
▸ TYMP P19971 1/20 0.43
▸ GSK3B P49841 1/20 0.42
▸ ADK P55263 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ ACMSD Q8TDX5 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP2A6 P11509 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL9018786 0.91 CYP1A2 (0.50) CYP1A2PTPN22DHFRTYMPGSK3B
SCHEMBL31158554 0.83 CYP1A2 (0.46) CYP1A2PTPN22DHFRTYMPGSK3B
SCHEMBL2534631 0.82 ALDH1A1 (0.47) CYP1A2PTPN22DHFRGSK3BADK
SCHEMBL29587504 0.82 CYP1A2 (0.62) CYP1A2PTPN22DHFRTYMPGSK3B
SCHEMBL30772437 0.82 CYP1A2 (0.56) CYP1A2PTPN22DHFRTYMPGSK3B
SCHEMBL631770 0.82 CYP1A2 (0.62) CYP1A2PTPN22DHFRTYMPGSK3B
SCHEMBL30768160 0.81 DHFR (0.47) CYP1A2DHFRTYMPGSK3BADK
SCHEMBL599137 0.81 CYP1A2 (0.54) CYP1A2PTPN22MCL1ACMSDALDH1A1
SCHEMBL30336104 0.81 CYP1A2 (0.54) CYP1A2PTPN22MCL1ACMSDALDH1A1
SCHEMBL702934 0.80 ALDH1A1 (0.50) CYP1A2DHFRTYMPGSK3BADK

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
US-20250163228-A1 POLYESTER RESIN, RESIN COMPOSITION, CURED PRODUCT THEREOF, AND USE THEREOF AJINOMOTO CO., INC. (JP) 2025-05-22 — — US disclosed
WO-2024018949-A1 POLYESTER RESIN, RESIN COMPOSITION, CURED PRODUCT THEREOF, AND USE THEREOF 味の素株式会社 2024-01-25 — — WO disclosed
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