SCHEMBL9734925

SCHEMBL9734925

Cn1c(Cc2ccccc2Cl)nnc1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
MAP3K14 Q99558 1/20 0.43
GPR52 Q9Y2T5 1/20 0.41
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 2/20 0.40
TSHR P16473 2/20 0.40
POLB P06746 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
MEN1 O00255 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
NLRP3 Q96P20 1/20 0.39
MAPK1 P28482 1/20 0.38
ALK Q9UM73 1/20 0.38
ADRA1D P25100 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL9733669 0.81 ALDH1A1 (0.48) LMNAALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL3461538 0.68 LMNA (0.50) LMNAMAP3K14GPR52ALDH1A1KMT2A
SCHEMBL9500900 0.67 ALDH1A1 (0.49) LMNAALDH1A1KMT2APKMTSHR
SCHEMBL5742525 0.67 POLB (0.57) LMNAMAP3K14GPR52ALDH1A1KMT2A
SCHEMBL29849434 0.66 GAA (0.45) LMNAALDH1A1KMT2APOLBSMN1; SMN2
SCHEMBL10662392 0.64 GAA (0.50) LMNAMAP3K14ALDH1A1KMT2ATSHR
SCHEMBL1091961 0.63 PKM (0.64) LMNAMAP3K14ALDH1A1KMT2APKM
SCHEMBL672407 0.63 IDO1 (0.62) LMNAPKMTSHRNPC1RAB9A
SCHEMBL29519238 0.63 IDO1 (0.62) LMNAPKMTSHRNPC1RAB9A
SCHEMBL20552169 0.63 GAA (0.48) ALDH1A1KMT2APKMTSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5098922-A Anticonvulsants CIBA-GEIGY CORPORATION (US) 1992-03-24 US claimed
US-5045556-A Aralkyl-4H-1,2,4-triazole derivatives CIBA-GEIGY CORPORATION (US) 1991-09-03 US claimed
EP-0267147-B1 ARALKYL-4H-1,2,4-TRIAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1991-08-07 EP claimed
EP-0267147-A1 Aralkyl-4H-1,2,4-triazole derivatives CIBA-GEIGY AG (CH) 1988-05-11 EP claimed
US-5098922-A Anticonvulsants CIBA-GEIGY CORPORATION (US) 1992-03-24 US disclosed
US-5045556-A Aralkyl-4H-1,2,4-triazole derivatives CIBA-GEIGY CORPORATION (US) 1991-09-03 US disclosed
EP-0267147-B1 ARALKYL-4H-1,2,4-TRIAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1991-08-07 EP disclosed
EP-0267147-A1 Aralkyl-4H-1,2,4-triazole derivatives CIBA-GEIGY AG (CH) 1988-05-11 EP disclosed