SCHEMBL11404055

SCHEMBL11404055

O=C(O)c1ccccc1/N=C/c1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.53
▸ ALDH1A1 P00352 6/20 0.52
▸ HPGD P15428 5/20 0.50
▸ LMNA P02545 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ KDM4E B2RXH2 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ PBRM1 Q86U86 1/20 0.48
▸ AKR1C3 P42330 1/20 0.48
▸ AKR1C2 P52895 1/20 0.48
▸ AKR1C1 Q04828 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ TRPA1 O75762 1/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.47
▸ TLR2 O60603 1/20 0.45
▸ TLR1 Q15399 1/20 0.45
▸ TLR6 Q9Y2C9 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45

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
SCHEMBL11405776 0.89 TSHR (0.53) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11405780 0.89 TSHR (0.53) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11402270 0.87 ALDH1A1 (0.52) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11413775 0.87 TLR2 (0.62) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL10090711 0.86 ALDH1A1 (0.68) ALDH1A1HPGDLMNAHTTL3MBTL1
SCHEMBL11411252 0.83 TSHR (0.53) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11423281 0.83 TSHR (0.53) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11409315 0.82 HPGD (0.69) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL10812989 0.82 HPGD (0.69) PTGS2ALDH1A1HPGDLMNAHTT
SCHEMBL11424615 0.82 ALDH1A1 (0.46) PTGS2ALDH1A1HPGDLMNAHTT

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-4230727-A N-BENZYLIDENEANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1980-10-28 — — US disclosed
US-4187317-A Sunscreen and erythema treating with N-benzylidene anilenes WILLIAM H. RORER, INC. (US) 1980-02-05 — — US disclosed
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