SCHEMBL809744

SCHEMBL809744

c1ccc(COC2CCN3CCCN=C23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
CTSK P43235 2/20 0.40
CTSV O60911 1/20 0.40
CTSS P25774 1/20 0.40
CTSC P53634 1/20 0.40
CTSF Q9UBX1 1/20 0.40
SIGMAR1 Q99720 2/20 0.36
TMEM97 Q5BJF2 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT8 Q9NR22 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CYP2C19 P33261 1/20 0.36
TACR1 P25103 2/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35

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
SCHEMBL6860623 0.75 HSD11B1 (0.43) SMN1; SMN2
SCHEMBL6862009 0.72 HSD11B1 (0.40) CARM1PRMT6
SCHEMBL23871338 0.71 ESR1 (0.35) HRH3OPRM1
SCHEMBL23871337 0.66 SMN1; SMN2 (0.35) SMN1; SMN2
SCHEMBL25519240 0.65 CARM1 (0.40) CTSLCTSBCTSKCTSVCTSS
SCHEMBL27261515 0.65 TSHR (0.44) CTSLCTSBCTSKCYP2C19OPRM1
Bicarbonate SCHEMBL5176713 0.64 OPRM1 (0.50) CTSLCTSBCTSKSIGMAR1TMEM97
SCHEMBL20995912 0.63 PSEN1 (0.53) CTSLCTSBCTSKCTSVCTSS
SCHEMBL21359781 0.63 PSEN1 (0.53) CTSLCTSBCTSKCTSVCTSS
SCHEMBL3660170 0.63 OPRM1 (0.56) CTSLCTSBCTSKSIGMAR1TMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2098567-B1 ACRYLIC RUBBER COMPOSITION AND VULCANIZATE THEREOF DENKI KAGAKU KOGYO KK (JP) 2011-11-16 EP disclosed
US-8012556-B2 Acrylic rubber composition and its vulcanized product DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2011-09-06 US disclosed
US-20100009105-A1 ACRYLIC RUBBER COMPOSITION AND VULCANIZED PRODUCT DENKI KAGAKU KIGYO KABUSHIKI KAISHA (JP) 2010-01-14 US disclosed
EP-2098567-A1 ACRYLIC RUBBER COMPOSITION AND VULCANIZATE THEREOF Denki Kagaku Kogyo Kabushiki Kaisha (JP) 2009-09-09 EP disclosed