SCHEMBL9557402

SCHEMBL9557402

CCC(C)N(C(=O)c1cc(Cl)c(Cl)c(Cl)c1)N(CC)C(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.37
▸ HSP90AB1 P08238 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ LPAR1 Q92633 1/20 0.35
▸ LPAR5 Q9H1C0 1/20 0.35
▸ SRD5A2 P31213 2/20 0.35
▸ MDM4 O15151 1/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ RXRA P19793 2/20 0.33
▸ RXRB P28702 2/20 0.33
▸ RXRG P48443 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33

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
SCHEMBL9558057 0.86 TSHR (0.36) HSP90AA1HSP90AB1KMT2ASMN1; SMN2TSHR
SCHEMBL9557549 0.79 ALDH1A1 (0.46) KMT2ASMN1; SMN2TSHRMAPTALDH1A1
SCHEMBL9826137 0.76 ALDH1A1 (0.39) HSP90AA1HSP90AB1KMT2ASMN1; SMN2TSHR
SCHEMBL11782049 0.72 HSP90AA1 (0.38) HSP90AA1HSP90AB1KMT2ATSHRALDH1A1
SCHEMBL9557703 0.71 TSHR (0.41) HSP90AA1HSP90AB1SMN1; SMN2TSHRALDH1A1
SCHEMBL9557674 0.67 ALDH1A1 (0.49) KMT2ASMN1; SMN2MAPTALDH1A1GAA
SCHEMBL11782048 0.65 TSHR (0.54) HSP90AA1HSP90AB1TSHRHPGD
SCHEMBL3365999 0.65 TSHR (0.52) HSP90AA1HSP90AB1TSHRHPGD
SCHEMBL9558054 0.65 ALDH1A1 (0.46) KMT2AMAPTALDH1A1GAAHPGD
SCHEMBL9557591 0.63 ALDH1A1 (0.44) KMT2ASMN1; SMN2MAPTALDH1A1HPGD

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
US-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 — — US disclosed
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 — — EP disclosed
EP-0245950-A2 Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-11-19 — — EP disclosed
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