SCHEMBL11223980

SCHEMBL11223980

CC(C)c1cc(C2CCCCC2)cc(C(=O)O)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.54
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 3/20 0.42
KMO O15229 1/20 0.41
KMT2A Q03164 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
DHODH Q02127 1/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
APP P05067 1/20 0.36
SERPINE1 P05121 1/20 0.36
WDR5 P61964 2/20 0.36
MCL1 Q07820 2/20 0.36
BCL2 P10415 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36

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
SCHEMBL27698484 0.84 CA1 (0.48) ACMSDHPGDHIF1AGABRA1GABRB1
SCHEMBL9282682 0.84 ACMSD (0.50) ACMSDKDM4EHPGDKMOKMT2A
SCHEMBL9251173 0.80 ACMSD (0.58) ACMSDKDM4EALDH1A1HPGDKMO
SCHEMBL11777644 0.80 ACMSD (0.66) ACMSDKDM4EALDH1A1KMOKMT2A
SCHEMBL2533444 0.80 ACMSD (0.61) ACMSDKDM4EKMOKMT2ATDP1
SCHEMBL7955284 0.78 ACMSD (0.59) ACMSDKDM4EKMOKMT2ATDP1
SCHEMBL11231372 0.77 ACMSD (0.58) ACMSDKDM4EALDH1A1HPGDKMO
SCHEMBL9622089 0.77 GABRA1 (0.43) ACMSDHIF1AGABRA1GABRB1GLRA1
SCHEMBL27579601 0.77 GABRA1 (0.43) ACMSDGABRA1GABRB1GLRA1CNR2
SCHEMBL27579607 0.77 GABRA1 (0.43) ACMSDKDM4EALDH1A1HPGDKMT2A

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-4355070-A COLOR FORMER, DEVELOPER, HEAT FUSIBLE MATERIAL AND OIL ABSORPTIVE PIGMENT KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1982-10-19 US disclosed
US-4311758-A INORGANIC PIGMENTS IN THE COLOR DEVELOPER LAYER KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1982-01-19 US disclosed
US-4236732-A COLOR DEVELOPING LAYER CONTAINING PARTICLES OF A CHROMOGENIC MATERIAL, AN ACCEPTOR AND A HEAT FUSIBLE MATERIAL KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1980-12-02 US disclosed
US-4228222-A COLOR DEVELOPING LAYER INCLUDING WATER SOLUBLE RESIN AS BINDER KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1980-10-14 US disclosed
US-4168845-A Heat-sensitive record material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1979-09-25 US disclosed