SCHEMBL9645677

SCHEMBL9645677

CCOC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.74
SMN1; SMN2 Q16637 6/20 0.74
NPC1 O15118 6/20 0.74
GAA P10253 2/20 0.74
MAPT P10636 4/20 0.71
LMNA P02545 2/20 0.71
HDAC3 O15379 1/20 0.63
HDAC11 Q96DB2 1/20 0.63
HDAC8 Q9BY41 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63
TRPV1 Q8NER1 4/20 0.62
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 1/20 0.60
KMT2A Q03164 1/20 0.60
NR1H4 Q96RI1 1/20 0.59
PDK1 Q15118 1/20 0.59
PDK2 Q15119 1/20 0.59
PDK3 Q15120 1/20 0.59
PDK4 Q16654 1/20 0.59
TSHR P16473 2/20 0.58

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
SCHEMBL5879030 0.91 RAB9A (0.88) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL10943445 0.91 RAB9A (0.88) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL571045 0.87 CA12 (0.63) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL9182180 0.87 RAB9A (0.72) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL14706883 0.86 SMN1; SMN2 (0.68) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL196507 0.86 SMN1; SMN2 (0.61) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL4724997 0.85 SMN1; SMN2 (1.00) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL4611487 0.84 HDAC3 (0.71) RAB9ASMN1; SMN2NPC1MAPTLMNA
SCHEMBL3882727 0.84 HDAC3 (0.71) RAB9ASMN1; SMN2NPC1MAPTLMNA
SCHEMBL9646009 0.84 RAB9A (0.53) RAB9ASMN1; SMN2NPC1GAAMAPT

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
EP-0346713-B1 BENZAMIDINES USEFUL AS ULTRAVIOLET LIGHT ABSORBERS L. GIVAUDAN & CIE Société Anonyme (CH) 1992-09-16 EP disclosed
US-5011628-A N,N'-diarylbenzamidines useful as ultraviolet light absorbers GIVAUDAN CORPORATION (US) 1991-04-30 US disclosed