SCHEMBL7517870

SCHEMBL7517870

CC(C)(C)c1ccc2oc(COCC(=O)NCc3cccc(CN)c3)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
CETP P11597 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
RAB9A P51151 3/20 0.35
MAPT P10636 3/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK1 P28482 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL7516002 0.88 P2RY14 (0.39) CETPRAB9AMAPTKMT2ARXFP1
SCHEMBL7512433 0.86 POLB (0.41) LMNANR1H4RAB9AMAPTNPC1
SCHEMBL7515762 0.86 TP53 (0.41) LMNAMAPTNPC1HPGDSMN1; SMN2
SCHEMBL7886119 0.78 LOXL2 (0.46) LMNACETPRAB9AMAPTNPC1
SCHEMBL7518226 0.73 TSHR (0.48) RAB9AMAPTNPC1ALDH1A1POLB
SCHEMBL19953382 0.70 NPC1 (0.51) RAB9AMAPTNPC1SMN1; SMN2POLB
SCHEMBL7520218 0.68 KMT2A (0.56) LMNARAB9ANPC1HPGDSMN1; SMN2
SCHEMBL12993470 0.66 HSD17B10 (0.51) LMNANR1H4HPGDSMN1; SMN2ALDH1A1
SCHEMBL4905164 0.66 LOXL2 (0.55) RAB9AMAPTNPC1SMN1; SMN2POLB
SCHEMBL11337498 0.65 NPC1 (0.47) LMNARAB9AMAPTNPC1SMN1; SMN2

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-1007518-A4 SOLID AND LIQUID-PHASE SYNTHESIS OF BENZOXAZOLES AND BENZOTHIAZOLES AND THEIR USE SEPRACOR INC (US) 2002-11-06 EP disclosed
EP-1007518-A1 SOLID AND LIQUID-PHASE SYNTHESIS OF BENZOXAZOLES AND BENZOTHIAZOLES AND THEIR USE SEPRACOR, INC. (US) 2000-06-14 EP disclosed
WO-1999009017-A1 SOLID AND LIQUID-PHASE SYNTHESIS OF BENZOXAZOLES AND BENZOTHIAZOLES AND THEIR USE SEPRACOR INC. (US) 1999-02-25 WO disclosed