SCHEMBL4839145

SCHEMBL4839145

CC(C)(C)OC(=O)Nc1cc(F)c(F)cc1C(=O)NCC(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 8/20 0.57
HTR4 Q13639 2/20 0.45
FAAH O00519 1/20 0.45
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45
CHRM4 P08173 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.44
CACNA1I Q9P0X4 1/20 0.44
TP53 P04637 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL4846627 0.91 CCR2 (0.53) CCR2HTR4
SCHEMBL6205492 0.88 CCR2 (0.45) CCR2HTR4ACHEMEN1KMT2A
SCHEMBL4848476 0.88 CCR2 (0.50) CCR2HTR4
SCHEMBL4848587 0.88 CCR2 (0.47) CCR2HTR4FAAHBCHEACHE
SCHEMBL7620460 0.88 CCR2 (0.47) CCR2CHRM4MEN1KMT2AKCNH2
SCHEMBL4846821 0.88 CCR2 (0.70) CCR2KCNH2CACNA1I
SCHEMBL4839079 0.88 CCR2 (0.44) CCR2HTR4ACHEMEN1KMT2A
SCHEMBL4850062 0.86 CCR2 (0.44) CCR2HTR4FAAHBCHEACHE
SCHEMBL4841085 0.81 ACACB (0.43) CCR2HTR4CHRM4
SCHEMBL6206317 0.81 CCR2 (0.74) CCR2HTR4FAAHBCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390830-B1 Remedies or prophylactics for diseases in association with chemokines TEIJIN LIMITED (JP) 2008-06-24 US disclosed
EP-1179341-B1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LTD (JP) 2005-11-09 EP disclosed
EP-1553085-A1 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-07-13 EP disclosed
EP-1535909-A2 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-06-01 EP disclosed
CN-1384743-A Remedies or preventives for diseases in association with chemokines TEIJIN LTD (JP) 2002-12-11 CN disclosed
US-6451842-B1 Cyclic amine derivatives and their use as drugs DUPONT PHARMACEUTICALS COMPANY 2002-09-17 US disclosed
US-6410566-B1 ATHEROSCLEROSIS; ANTIARTHRITIC AGENTS TEIJIN LIMITED (JP) 2002-06-25 US disclosed
US-6362177-B1 INHIBITION OF CHEMOKINE BINDING TEIJIN LIMITED (JP) 2002-03-26 US disclosed
EP-1179341-A1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LIMITED (JP) 2002-02-13 EP disclosed