SCHEMBL9365751

SCHEMBL9365751

CNc1ccc(/C=C/C=C(\C#N)C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HPGD P15428 2/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MCL1 Q07820 2/20 0.52
APP P05067 3/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
MAOB P27338 1/20 0.47
KMT2A Q03164 1/20 0.46
CISD1 Q9NZ45 1/20 0.43
SLC16A3 O15427 1/20 0.43
CYP3A4 P08684 1/20 0.43
SLC16A1 P53985 1/20 0.43
GPR35 Q9HC97 1/20 0.43

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
SCHEMBL9365752 1.00 LMNA (0.55) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9360835 0.94 APP (0.56) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9360827 0.94 APP (0.56) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9508065 0.87 MCL1 (0.65) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9361771 0.86 LMNA (0.59) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9361768 0.86 LMNA (0.59) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9360876 0.85 LMNA (0.55) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9361502 0.83 MCL1 (0.56) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9361497 0.83 MCL1 (0.56) LMNAKDM4EALDH1A1HPGDHTT
SCHEMBL9362098 0.82 LMNA (0.55) LMNAKDM4EALDH1A1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335641-B1 Organic nonlinear optical substance TEIJIN LTD (JP) 1994-01-05 EP disclosed
US-5196147-A Optical crystals TEIJIN LIMITED (JP) 1993-03-23 US disclosed
EP-0335641-A2 Organic nonlinear optical substance TEIJIN LIMITED (JP) 1989-10-04 EP disclosed