SCHEMBL8306672

SCHEMBL8306672

CCN=C(C)N(C#N)Cc1ccc(Cl)nc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
AR P10275 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ATM Q13315 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
POLB P06746 1/20 0.34
CHRNA7 P36544 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 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
SCHEMBL7752205 0.86 ALDH1A1 (0.41) ALDH1A1ARMEN1KMT2AATM
SCHEMBL7752201 0.86 ALDH1A1 (0.41) ALDH1A1ARMEN1KMT2AATM
SCHEMBL3261553 0.81 ALDH1A1 (0.43) ALDH1A1ARMEN1KMT2AATM
SCHEMBL15467058 0.75 ALDH1A1 (0.36) ALDH1A1ARMEN1KMT2AATM
SCHEMBL10028746 0.74 ALDH1A1 (0.40) ALDH1A1ARMEN1KMT2AATM
SCHEMBL764579 0.74 ALDH1A1 (0.40) ALDH1A1ARMEN1KMT2AATM
SCHEMBL14304158 0.74 ALDH1A1 (0.40) ALDH1A1ARMEN1KMT2AATM
Acetamiprid SCHEMBL26296 0.73 ALDH1A1 (0.41) ALDH1A1ARMEN1KMT2AATM
Acetamiprid SCHEMBL15757338 0.73 ALDH1A1 (0.41) ALDH1A1ARMEN1KMT2AATM
SCHEMBL1405688 0.73 ALDH1A1 (0.44) ALDH1A1ARMEN1KMT2AATM

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5304566-A Pyridine compounds which have useful insecticidal utility NIPPON SODA CO., LTD (JP) 1994-04-19 US claimed
EP-0456826-B1 AMINE DERIVATIVES NIPPON SODA CO (JP) 1999-01-07 EP disclosed
US-5612358-A Pyridine compouds which have useful insecticidal activity NIPPON SODA CO., LTD. (JP) 1997-03-18 US disclosed
US-5304566-A Pyridine compounds which have useful insecticidal utility NIPPON SODA CO., LTD (JP) 1994-04-19 US disclosed
EP-0456826-A1 AMINE DERIVATIVES NIPPON SODA CO., LTD. (JP) 1991-11-21 EP disclosed
WO-1991004965-A1 AMINE DERIVATIVES NIPPON SODA CO., LTD. (JP) 1991-04-18 WO disclosed