SCHEMBL7758682

SCHEMBL7758682

Clc1ccc2s[c]nc2c1Cl

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL558384 0.80 MAPT (0.40) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL558383 0.80
SCHEMBL558547 0.76 ALDH1A1 (0.39) LMNAPOLBMAPTRAB9ATDP1
SCHEMBL558548 0.76 ALDH1A1 (0.40) GAA
SCHEMBL9674373 0.70 SMN1; SMN2 (0.41) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL11697395 0.67
SCHEMBL5000270 0.67 ALDH1A1 (0.44) NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL557660 0.67 NPC1 (0.33) NPC1GAAMAPTRAB9A
SCHEMBL7778994 0.67
SCHEMBL10411212 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594047-B1 Arylazo chromoionophores BAYER AG (US) 2000-01-05 EP claimed
US-5310888-A Calcium detection MILES INC. (US) 1994-05-10 US claimed
EP-0594047-A1 Arylazo chromoionophores Bayer Corporation (US) 1994-04-27 EP claimed
EP-1085058-A1 Mixtures of azo dyes Ciba SC Holding AG (CH) 2001-03-21 EP disclosed
EP-0594047-B1 Arylazo chromoionophores BAYER AG (US) 2000-01-05 EP disclosed
US-5310888-A Calcium detection MILES INC. (US) 1994-05-10 US disclosed
EP-0594047-A1 Arylazo chromoionophores Bayer Corporation (US) 1994-04-27 EP disclosed