SCHEMBL9362059

SCHEMBL9362059

COC(=O)c1ccc(C=CC=C(C#N)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.50
▸ APP P05067 1/20 0.50
▸ LMNA P02545 7/20 0.49
▸ MAPT P10636 6/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ HTT P42858 3/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MITF O75030 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ HPGD P15428 1/20 0.49
▸ PTPN1 P18031 1/20 0.47
▸ NPC1 O15118 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ RAB9A P51151 2/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 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
SCHEMBL9362053 1.00 MCL1 (0.50) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9361399 0.95 APP (0.57) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9361403 0.95 APP (0.57) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9360595 0.85 MAPT (0.49) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9360589 0.85 MAPT (0.49) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9508065 0.85 MCL1 (0.65) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9364799 0.83 LMNA (0.48) MCL1APPLMNAMAPTALDH1A1
SCHEMBL9364802 0.83 LMNA (0.48) MCL1APPLMNAMAPTALDH1A1
SCHEMBL6375833 0.83 MCL1 (0.52) MCL1APPLMNAMAPTALDH1A1
SCHEMBL6375831 0.83 MCL1 (0.52) MCL1APPLMNAMAPTALDH1A1

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
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