SCHEMBL11677404

SCHEMBL11677404

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CNC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
POLB P06746 1/20 0.59
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
TSHR P16473 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MMP1 P03956 1/20 0.50
PLK1 P53350 1/20 0.49
GLA P06280 1/20 0.49
SMPD1 P17405 3/20 0.49

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
SCHEMBL11676473 1.00 NAAA (0.61) NAAATDP1POLBMEN1KMT2A
SCHEMBL27623142 1.00 NAAA (0.61) NAAATDP1POLBMEN1KMT2A
SCHEMBL27530408 0.94 POLB (0.66) NAAATDP1POLBMEN1KMT2A
SCHEMBL11675750 0.92 TDP1 (0.59) NAAATDP1POLBMEN1KMT2A
SCHEMBL11677909 0.86 MEN1 (0.79) TDP1POLBMEN1KMT2ANPC1
SCHEMBL11675778 0.86 NAAA (0.67) NAAAMEN1KMT2ANPC1RAB9A
SCHEMBL8063746 0.85 NAAA (0.69) NAAAMEN1KMT2ANPC1RAB9A
SCHEMBL11678436 0.85 NAAA (0.69) NAAAMEN1KMT2ANPC1RAB9A
SCHEMBL23969603 0.84 POLB (0.68) TDP1POLBMEN1KMT2ATSHR
SCHEMBL11677530 0.82 ALDH1A1 (0.60) TDP1POLBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4016287-A COSMETIC AND ANTIINFLAMMATORY BOEHRINGER INGELHEIM GMBH (DT) 1977-04-05 US disclosed