SCHEMBL24482811

SCHEMBL24482811

Cc1cc(F)c2nc(C)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.50
CCR5 P51681 3/20 0.50
RAB9A P51151 1/20 0.50
CYP1A2 P05177 5/20 0.45
CCR8 P51685 2/20 0.43
METAP2 P50579 1/20 0.38
CYP2A6 P11509 2/20 0.37
PSMD14 O00487 1/20 0.35
COPS5 Q92905 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
CASP6 P55212 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL6088636 0.85 CCR1 (0.52) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL24619705 0.83 CCR1 (0.43) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL2119571 0.80 CCR1 (0.46) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL2119502 0.80 CCR1 (0.46) CCR1CCR5RAB9ACYP1A2METAP2
SCHEMBL24207564 0.80 KDM4E (0.48) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL24482788 0.80 CCR1 (0.46) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL22509683 0.80 BACE1 (0.48) CCR1CCR5RAB9ACYP1A2CCR8
SCHEMBL24619702 0.80 CCR1 (0.41) CCR1CCR5CYP1A2CCR8CYP2A6
SCHEMBL24619662 0.80 CCR1 (0.41) CCR1CCR5CYP1A2CCR8CYP2A6
SCHEMBL11804743 0.78 CCR1 (0.54) CCR1CCR5RAB9ACYP1A2CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022113003-A1 CDK INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2022-06-02 WO disclosed