SCHEMBL8396278

SCHEMBL8396278

CCOC(=O)CCC(=O)N(Cc1nc2cc(F)cc(F)c2s1)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
P2RX3 P56373 4/20 0.36
CFTR P13569 1/20 0.34
LMNA P02545 2/20 0.33
MDM2 Q00987 1/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
PRSS12 P56730 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL8400557 0.93 SMN1; SMN2 (0.41) AKR1B1SMN1; SMN2LMNATP53TSHR
SCHEMBL8395199 0.93 SMN1; SMN2 (0.43) AKR1B1SMN1; SMN2P2RX3NPC1TSHR
SCHEMBL8401802 0.91 SMN1; SMN2 (0.38) AKR1B1SMN1; SMN2TP53POLB
SCHEMBL8397933 0.91 SMN1; SMN2 (0.39) AKR1B1SMN1; SMN2TSHR
SCHEMBL8395933 0.91 SMN1; SMN2 (0.51) AKR1B1SMN1; SMN2
SCHEMBL8399334 0.90 SMN1; SMN2 (0.40) AKR1B1SMN1; SMN2LMNANPC1MAOB
SCHEMBL8399094 0.90 SMN1; SMN2 (0.39) AKR1B1SMN1; SMN2LMNANPC1TSHR
SCHEMBL8395400 0.90 SMN1; SMN2 (0.39) AKR1B1SMN1; SMN2P2RX3LMNATP53
SCHEMBL8399296 0.89 SMN1; SMN2 (0.38) AKR1B1SMN1; SMN2LMNATSHR
SCHEMBL8396400 0.88 MEN1 (0.38) AKR1B1SMN1; SMN2LMNATP53MAOB

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