SCHEMBL10618898

SCHEMBL10618898

CCc1ccc(NNC=C(C#N)C#N)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.36
▸ GAA P10253 4/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TRPA1 O75762 2/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPT P10636 2/20 0.30
▸ AGTR1 P30556 1/20 0.30

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
SCHEMBL10997156 0.89 GAA (0.36) RAB9AGAASMN1; SMN2POLBALDH1A1
SCHEMBL10618076 0.81 — —
SCHEMBL10616544 0.81 GABRA1 (0.44) RAB9AGAANPC1SMN1; SMN2POLB
SCHEMBL10616852 0.78 DHODH (0.32) RAB9AGAASMN1; SMN2KMT2AALDH1A1
SCHEMBL10618418 0.77 KMT2A (0.35) RAB9AGAAKMT2AKDM4E
SCHEMBL10620530 0.75 ALDH1A1 (0.48) SMN1; SMN2POLBKMT2AALDH1A1KDM4E
SCHEMBL6213922 0.74 MAPK1 (0.49) RAB9AGAANPC1SMN1; SMN2EGFR
SCHEMBL10619032 0.73 TRPA1 (0.35) GAASMN1; SMN2POLBKMT2AALDH1A1
SCHEMBL10618073 0.73 ESRRG (0.33) KMT2AALDH1A1KDM4EHPGDCYP2A6
SCHEMBL10987624 0.72 KMT2A (0.33) RAB9AGAAKMT2AALDH1A1KDM4E

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
EP-0083613-B1 N-PHENYLPYRAZOLE DERIVATIVES USEFUL AS HERBICIDES MAY & BAKER LIMITED (GB) 1988-06-01 — — EP disclosed
US-4459150-A 5-Acylamino-4-cyano-1-phenylpyrazole derivatives and use as herbicides MAY & BAKER LIMITED (GB) 1984-07-10 — — US disclosed
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