SCHEMBL6772036

SCHEMBL6772036

NC(=O)c1cccc2c1c1c(O)cc(-c3ccc(Cl)cc3)cc1n2Cc1ccc2ccccc2c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.41
F10 P00742 2/20 0.39
PLA2G2A P14555 1/20 0.39
ICMT O60725 3/20 0.38
PPARG P37231 2/20 0.38
CTRB1 P17538 1/20 0.38
OPRL1 P41146 1/20 0.38
CNR2 P34972 1/20 0.38
PTGS2 P35354 1/20 0.37
DRD2 P14416 1/20 0.37
TBXA2R P21731 1/20 0.37
MCHR1 Q99705 1/20 0.37
NPY5R Q15761 1/20 0.37
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36

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
SCHEMBL6775883 0.92 CTRB1 (0.41) CCR2F10PLA2G2AICMTCTRB1
SCHEMBL6690216 0.90 PLA2G2A (0.43) CCR2PLA2G2APPARGIKBKBCHUK
SCHEMBL6776773 0.88 PLA2G2A (0.42) CCR2PLA2G2APPARG
SCHEMBL6776758 0.88 PLA2G2A (0.50) CCR2F10PLA2G2A
SCHEMBL6891577 0.88 DRD2 (0.47) CCR2PPARGDRD2TBXA2R
SCHEMBL6771677 0.86 PLA2G2A (0.41) CCR2PLA2G2APPARGCNR2
SCHEMBL6774857 0.86 FAAH (0.43) CCR2PLA2G2AICMTPPARG
SCHEMBL7963393 0.86 PLA2G2A (0.47) PLA2G2A
SCHEMBL6770697 0.86 F10 (0.46) CCR2F10PLA2G2AICMTCTRB1
SCHEMBL6772770 0.85 PLA2G2A (0.41) F10PLA2G2AICMT

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
US-6713645-B1 INHIBITING SPLA2 MEDIATED RELEASE OF FATTY ACIDS FOR TREATMENT OF CONDITIONS SUCH AS SEPTIC SHOCK ELI LILLY AND COMPANY 2004-03-30 US disclosed
US-6177440-B1 THERAPY FOR SEPSIS SHOCK; PHOSPHOLIPASE INHBITOR ELI LILLY AND COMPANY 2001-01-23 US disclosed
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP disclosed