SCHEMBL29965144

SCHEMBL29965144

Cn1nc(Nc2ccc(C(F)(F)F)cc2)c2ncn(CC(=O)NC3CCC(OC(F)F)CC3)c(=O)c21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 11/20 0.38
KCNH2 Q12809 9/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
CCRL2 O00421 2/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
ABL1 P00519 1/20 0.35
ENPP2 Q13822 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
SCHEMBL24750365 1.00 CCR2 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750376 1.00 CCR2 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750380 0.91 TDP1 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750206 0.91 TDP1 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750371 0.91 TDP1 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750374 0.91 TDP1 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750202 0.91 TDP1 (0.38) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750381 0.91 CCR2 (0.39) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL29965690 0.91 CCR2 (0.39) CCR2KCNH2TDP1LMNACCRL2
SCHEMBL24750382 0.90 EPHX2 (0.37) CCR2KCNH2LMNAKMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313988-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2024-02-07 EP disclosed
WO-2022204481-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2022-09-29 WO disclosed