SCHEMBL8400414

SCHEMBL8400414

CCOC(=O)CCC(=O)N(Cc1nc2c(Cl)c(Cl)ccc2s1)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
P2RX3 P56373 2/20 0.35
CFTR P13569 1/20 0.35
AKR1B1 P15121 1/20 0.35
CNR2 P34972 2/20 0.34
NPC1 O15118 2/20 0.34
CNR1 P21554 1/20 0.34
LMNA P02545 4/20 0.34
TP53 P04637 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PRSS12 P56730 1/20 0.34
MAPT P10636 4/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.33
TSHR P16473 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
SCHEMBL8398032 0.94 SMN1; SMN2 (0.44) SMN1; SMN2P2RX3AKR1B1CNR2NPC1
SCHEMBL8396376 0.92 SMN1; SMN2 (0.40) SMN1; SMN2AKR1B1NPC1LMNAMEN1
SCHEMBL8397981 0.92 SMN1; SMN2 (0.40) SMN1; SMN2AKR1B1NPC1LMNAMEN1
SCHEMBL8396242 0.92 SMN1; SMN2 (0.52) SMN1; SMN2AKR1B1NPC1TP53MEN1
SCHEMBL8396653 0.92 SMN1; SMN2 (0.39) SMN1; SMN2AKR1B1NPC1LMNATP53
SCHEMBL8400255 0.92 SMN1; SMN2 (0.39) SMN1; SMN2P2RX3AKR1B1CNR2NPC1
SCHEMBL8395662 0.92 SMN1; SMN2 (0.39) SMN1; SMN2LMNATP53MEN1KMT2A
SCHEMBL8398087 0.91 SMN1; SMN2 (0.39) SMN1; SMN2AKR1B1NPC1TP53MEN1
SCHEMBL8399636 0.89 SMN1; SMN2 (0.38) SMN1; SMN2P2RX3AKR1B1NPC1LMNA
SCHEMBL8400310 0.89 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1NPC1LMNAMAPT

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-0647636-B1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF SENJU PHARMA CO (JP) 1999-06-09 EP disclosed
US-5532257-A ENZYME INHIBITOR SENJU PHARMACEUTICAL CO., LTD (JP) 1996-07-02 US disclosed
EP-0647636-A1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Senju Pharmaceutical Co., Ltd. (JP) 1995-04-12 EP disclosed