SCHEMBL648124

SCHEMBL648124

CCCCn1c(-c2ccccc2)nc(-c2ccccc2)c1CN(Cc1cccc(C(F)(F)F)c1)Cc1ccc(O)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TRPV4 Q9HBA0 5/20 0.35
CRHR1 P34998 1/20 0.34
ICMT O60725 1/20 0.34
P2RX3 P56373 1/20 0.34
UBE2M P61081 3/20 0.34
DCUN1D1 Q96GG9 3/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
MAPT P10636 1/20 0.34
ESR1 P03372 1/20 0.33
ADORA2B P29275 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL653273 0.91 C5AR1 (0.41) C5AR1MEN1KMT2ATRPV4CRHR1
SCHEMBL4764487 0.91 C5AR1 (0.43) C5AR1MEN1KMT2ACRHR1ESR1
SCHEMBL5136126 0.88 C5AR1 (0.40) C5AR1CRHR1ESR1
SCHEMBL650105 0.88 C5AR1 (0.46) C5AR1MEN1KMT2ATRPV4CRHR1
SCHEMBL5138072 0.86 C5AR1 (0.43) C5AR1MEN1KMT2ACRHR1ESR1
SCHEMBL648704 0.85 C5AR1 (0.42) C5AR1MEN1KMT2ATRPV4CRHR1
SCHEMBL652017 0.85 C5AR1 (0.43) C5AR1CRHR1ICMTCNR1CNR2
SCHEMBL5137492 0.85 C5AR1 (0.42) C5AR1MEN1KMT2ACRHR1ESR1
SCHEMBL5136841 0.85 C5AR1 (0.39) C5AR1MEN1KMT2AMAPT
SCHEMBL5136743 0.85 C5AR1 (0.45) C5AR1MEN1KMT2ATRPV4CRHR1

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
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed