SCHEMBL11409738

SCHEMBL11409738

O=C(O)c1ccc(/C=N/c2ccc(Cl)cc2Cl)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.48
▸ TSHR P16473 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ CASP1 P29466 1/20 0.45
▸ SRD5A2 P31213 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TTR P02766 2/20 0.41
▸ POLB P06746 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PYGL P06737 2/20 0.39
▸ HPGD P15428 1/20 0.39

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
SCHEMBL11409741 1.00 LMNA (0.48) LMNATSHRSMN1; SMN2CASP1SRD5A2
SCHEMBL11408875 0.87 MEN1 (0.45) TSHRSMN1; SMN2CASP1SRD5A2ALDH1A1
SCHEMBL11408874 0.87 MEN1 (0.45) TSHRSMN1; SMN2CASP1SRD5A2ALDH1A1
SCHEMBL11404916 0.83 LMNA (0.50) LMNATSHRSMN1; SMN2CASP1ALDH1A1
SCHEMBL11425756 0.80 DHODH (0.50) LMNATSHRSMN1; SMN2CASP1SRD5A2
SCHEMBL11425754 0.80 DHODH (0.50) LMNATSHRSMN1; SMN2CASP1SRD5A2
SCHEMBL11418731 0.78 ALDH1A1 (0.47) LMNATSHRSMN1; SMN2ALDH1A1TP53
SCHEMBL11418727 0.78 ALDH1A1 (0.47) LMNATSHRSMN1; SMN2ALDH1A1TP53
SCHEMBL11431151 0.77 MEN1 (0.46) LMNATSHRSRD5A2ALDH1A1TTR
SCHEMBL11431148 0.77 MEN1 (0.46) LMNATSHRSRD5A2ALDH1A1TTR

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-4200648-A INFLAMMATION BY ADMINISTERING A BENZYLIDENEANILINE DERIVATIVE WILLIAM H. RORER, INC. (US) 1980-04-29 — — US disclosed
US-4198349-A ANTIINFLAMMATORY, TOPICAL WILLIAM H. RORER, INC. (US) 1980-04-15 — — US disclosed
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