SCHEMBL7905433

SCHEMBL7905433

CNc1nc(-c2c(OC)cc(OC)cc2OC)cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
RAB9A P51151 6/20 0.53
ECE1 P42892 1/20 0.49
TUBB4A P04350 1/20 0.49
TUBB P07437 1/20 0.49
TUBA3C P0DPH7 1/20 0.49
TUBA1B P68363 1/20 0.49
TUBA4A P68366 1/20 0.49
TUBB4B P68371 1/20 0.49
TUBB3 Q13509 1/20 0.49
TUBB2A Q13885 1/20 0.49
TUBB8 Q3ZCM7 1/20 0.49
TUBA3E Q6PEY2 1/20 0.49
TUBA1A Q71U36 1/20 0.49
TUBA1C Q9BQE3 1/20 0.49
TUBB6 Q9BUF5 1/20 0.49
TUBB2B Q9BVA1 1/20 0.49
TUBB1 Q9H4B7 1/20 0.49
AR P10275 1/20 0.47

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
SCHEMBL2379547 0.79 ALDH1A1 (0.56) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL28154591 0.76 RAB9A (0.53) MEN1KMT2ARAB9ATUBB4ATUBB
SCHEMBL12300962 0.75 MAPT (0.63) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL24590341 0.74 PTGS2 (0.72) MEN1KMT2ARAB9ATUBB4ATUBB
SCHEMBL16208839 0.74 MEN1 (0.69) MEN1KMT2ARAB9AARNPC1
SCHEMBL13513658 0.73 NPC1 (0.70) MEN1KMT2ARAB9AARNPC1
SCHEMBL14048211 0.73 MEN1 (0.69) MEN1KMT2ARAB9AECE1AR
SCHEMBL15134849 0.72 ALDH1A1 (0.52) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL24590484 0.72 VCP (0.65) MEN1KMT2ARAB9AARNPC1
SCHEMBL29419331 0.72 VCP (0.65) MEN1KMT2ARAB9AARNPC1

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
US-RE37094-E1 Heterocyclic substituted acylaminothiazoles, their preparation and pharmaceutical compositions containing them SANOFI (FR) 2001-03-13 US disclosed
US-5189049-A Cholecystokinin and gastrin inhibitors SANOFI (FR) 1993-02-23 US disclosed