SCHEMBL9370428

SCHEMBL9370428

O=C(Nc1nc(-c2cccc(Cl)c2)cs1)N1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.65
GSTO1 P78417 1/20 0.61
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
MAPT P10636 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
CNR2 P34972 1/20 0.53
ALDH1A1 P00352 1/20 0.53
RECQL P46063 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
NPC1 O15118 2/20 0.52
ROCK2 O75116 1/20 0.52
ROCK1 Q13464 1/20 0.52
KDM1A O60341 1/20 0.51
MAOA P21397 1/20 0.51
LMNA P02545 1/20 0.51
CFTR P13569 2/20 0.51
FAAH O00519 1/20 0.51
RORC P51449 1/20 0.51
RAB9A P51151 1/20 0.50

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
SCHEMBL9374874 0.90 ABL1 (0.64) ABL1GSTO1MEN1KMT2AMAPT
SCHEMBL9706553 0.90 ABL1 (0.58) ABL1GSTO1MEN1KMT2AMAPT
SCHEMBL9374616 0.89 LMNA (0.66) ABL1GSTO1MEN1KMT2AMAPT
SCHEMBL9371260 0.86 HDAC3 (0.56) ABL1CNR2NPC1ROCK2ROCK1
SCHEMBL9378540 0.86 MEN1 (0.59) ABL1MEN1KMT2AMAPTCNR2
SCHEMBL9370967 0.86 ABL1 (0.62) ABL1GSTO1MEN1KMT2AMAPT
SCHEMBL9371263 0.86 NPC1 (0.68) GSTO1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL9373501 0.85 ABL1 (0.65) ABL1MEN1KMT2AMAPTRECQL
SCHEMBL9370668 0.84 ALDH1A1 (0.69) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL9371376 0.83 KMT2A (0.64) MEN1KMT2AMAPTALDH1A1MAOA

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
EP-0589985-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1994-04-06 EP disclosed
WO-1993000342-A1 2-AMINO-4-ARYL-THIAZOLES WITH ANTIASTHMATIC AND ANTI-INFLAMMATORY ACTIVITIES ON THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-01-07 WO disclosed
EP-0519449-A1 2-Amino-4-aryl thiazoles with antiasthmatic and antiinflammatory activities on the respiratory tract BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-12-23 EP disclosed