SCHEMBL9333330

SCHEMBL9333330

COCC(=O)Nc1nc2ccc(F)cc2s1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.75
▸ NPC1 O15118 6/20 0.75
▸ RAB9A P51151 6/20 0.75
▸ TP53 P04637 4/20 0.75
▸ POLB P06746 1/20 0.69
▸ ALDH1A1 P00352 4/20 0.68
▸ PDPK1 O15530 1/20 0.67
▸ DYRK1A Q13627 1/20 0.67
▸ CSNK1D P48730 1/20 0.67
▸ PTPN1 P18031 1/20 0.63
▸ KMT2A Q03164 3/20 0.59
▸ MAPT P10636 2/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ TNF P01375 1/20 0.59
▸ LMNA P02545 1/20 0.59
▸ GAA P10253 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ NR2F2 P24468 1/20 0.59

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
SCHEMBL9332546 0.86 RAB9A (1.00) SMN1; SMN2NPC1RAB9ATP53POLB
SCHEMBL17776540 0.85 PDPK1 (0.72) SMN1; SMN2NPC1RAB9APOLBALDH1A1
SCHEMBL10936004 0.84 DYRK1A (0.75) SMN1; SMN2NPC1RAB9ATP53POLB
SCHEMBL4405589 0.83 NPC1 (0.63) SMN1; SMN2NPC1RAB9ATP53POLB
SCHEMBL17251987 0.83 PDPK1 (0.68) SMN1; SMN2NPC1RAB9APOLBALDH1A1
SCHEMBL8348837 0.83 PDPK1 (0.68) SMN1; SMN2NPC1RAB9APOLBALDH1A1
SCHEMBL30522062 0.83 PDPK1 (0.68) SMN1; SMN2NPC1RAB9APOLBALDH1A1
SCHEMBL7933342 0.83 PDPK1 (0.68) SMN1; SMN2NPC1RAB9APOLBALDH1A1
SCHEMBL9332424 0.81 SMN1; SMN2 (1.00) SMN1; SMN2NPC1RAB9ATP53POLB
SCHEMBL9332929 0.81 ALDH1A1 (1.00) SMN1; SMN2NPC1RAB9ATP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0397169-B1 Novel benzothiazole derivatives TOYO BOSEKI (JP) 1994-04-13 — — EP claimed
US-5036086-A Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-07-30 — — US claimed
EP-0397169-A1 Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA Trading under the name of Toyobo Co., Ltd. (JP) 1990-11-14 — — EP claimed
EP-0397169-B1 Novel benzothiazole derivatives TOYO BOSEKI (JP) 1994-04-13 — — EP disclosed
US-5036086-A Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-07-30 — — US disclosed
EP-0397169-A1 Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA Trading under the name of Toyobo Co., Ltd. (JP) 1990-11-14 — — EP disclosed
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