SCHEMBL182627

SCHEMBL182627

O=C(O)c1c2c(c(C(=O)O)n1Cc1ccccc1)OCCO2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.46
EDNRB P24530 1/20 0.44
EDNRA P25101 1/20 0.44
FOLH1 Q04609 1/20 0.43
GPR35 Q9HC97 1/20 0.43
TSHR P16473 3/20 0.43
PKM P14618 2/20 0.43
NOTUM Q6P988 1/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL2934311 0.89 MAPK8 (0.48) CCR2PKMGAALMNASMN1; SMN2
SCHEMBL2723479 0.83 MAPK8 (0.51) PKMGAALMNASMN1; SMN2ALDH1A1
SCHEMBL2931696 0.81 ALDH1A1 (0.54) TSHRPKMGAALMNASMN1; SMN2
SCHEMBL182646 0.77 FOLH1 (0.49) CCR2FOLH1GPR35TSHRPKM
SCHEMBL4236086 0.74 MAPK8 (0.43) TSHRPKMGAASMN1; SMN2ALDH1A1
SCHEMBL182544 0.74 CYP2D6 (0.41) TSHRLMNASMN1; SMN2POLBGSK3A
SCHEMBL3001518 0.73 GSK3B (0.52) CCR2FOLH1TSHRPKMNOTUM
SCHEMBL12513970 0.68 CYP19A1 (0.39) TSHRLMNASMN1; SMN2POLBGSK3A
SCHEMBL3252815 0.67 SMN1; SMN2 (0.35) SMN1; SMN2POLBHSD17B10ALDH1A1KDM4E
SCHEMBL3363334 0.67 MAPK8 (0.53) TSHRPKMNOTUMGAASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465962-B1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIV FLORIDA (US) 2012-01-04 EP disclosed
EP-1465962-B1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIV FLORIDA (US) 2012-01-04 EP disclosed
EP-1465962-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2004-10-13 EP disclosed
US-6791738-B2 CONTROLLING COLOR, BRIGHTNESS AND ENVIRONMENTAL STABILITY; POLY- 3,4-ALKYLENEDIOXYHETEROCYCLES UNIVERSITY OF FLORIDA 2004-09-14 US disclosed
US-20030174377-A1 Electrochromic polymers and polymer electrochromic devices UNIVERSITY OF FLORIDA 2003-09-18 US disclosed
WO-2003046106-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2003-06-05 WO disclosed