SCHEMBL8044894

SCHEMBL8044894

C=CC(=O)OCCCOc1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 3/20 0.54
ATM Q13315 1/20 0.54
HTR1B P28222 7/20 0.53
KCNA3 P22001 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
THRB P10828 1/20 0.50
SLC6A4 P31645 2/20 0.49
HRH1 P35367 1/20 0.49
HTR1D P28221 2/20 0.47
OGG1 O15527 1/20 0.47
MCL1 Q07820 4/20 0.46
BCL2 P10415 3/20 0.46
BCL2L1 Q07817 2/20 0.46
BAD Q92934 2/20 0.46
KMT2A Q03164 1/20 0.46
ALB P02768 1/20 0.46

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
SCHEMBL29459279 1.00 KDM4E (0.54) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL8041636 0.97 KCNA3 (0.55) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL29459162 0.96 KCNA3 (0.54) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL8038193 0.96 KCNA3 (0.54) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL3745947 0.96 KCNA3 (0.54) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL3743455 0.96 KCNA3 (0.54) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL29749590 0.93 THRB (0.59) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL67466 0.93 THRB (0.59) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL21312667 0.89 THRB (0.55) KDM4EALDH1A1HPGDATMHTR1B
SCHEMBL12112467 0.89 THRB (0.55) KDM4EALDH1A1HPGDATMHTR1B

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
WO-2000079312-A1 HIGH REFRACTIVE INDEX COMPOSITIONS FOR OPHTHALMIC IMPLANTS BAUSCH & LOMB SURGICAL, INC. (US) 2000-12-28 WO claimed
US-10633549-B2 Ink, ink accommodating container, image forming method, and image forming device RICOH COMPANY, LTD. (JP) 2020-04-28 US disclosed
US-20190264050-A1 INK, INK ACCOMMODATING CONTAINER, IMAGE FORMING METHOD, AND IMAGE FORMING DEVICE RICOH COMPANY, LTD. (JP) 2019-08-29 US disclosed
WO-2000079312-A1 HIGH REFRACTIVE INDEX COMPOSITIONS FOR OPHTHALMIC IMPLANTS BAUSCH & LOMB SURGICAL, INC. (US) 2000-12-28 WO disclosed