SCHEMBL27606349

SCHEMBL27606349

[O]CCc1ccc(F)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.49
▸ PNMT P11086 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ RPA1 P27694 1/20 0.44
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ SIGMAR1 Q99720 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PLA2G1B P04054 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ PTGES2 Q9H7Z7 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL15563577 0.83 TAAR1 (0.45) DAOPNMTTAAR1PIK3CARPA1
SCHEMBL5650950 0.83 PIK3CA (0.47) DAOPNMTTAAR1PIK3CARPA1
SCHEMBL793707 0.81 TAAR1 (0.69) DAOPNMTTAAR1SIGMAR1GAA
SCHEMBL23850015 0.81 TAAR1 (0.47) DAOPNMTTAAR1PIK3CARPA1
SCHEMBL7328450 0.80 PNMT (0.61) DAOPNMTTAAR1SIGMAR1MEN1
SCHEMBL530440 0.79 DAO (0.45) DAOPNMTTAAR1PIK3CATSHR
Hydrochloric Acid SCHEMBL3271461 0.79 TAAR1 (0.67) DAOPNMTTAAR1SIGMAR1GAA
SCHEMBL3264645 0.79 MAPT (0.47) DAOPNMTTAAR1PIK3CARPA1
SCHEMBL17552730 0.79 TAAR1 (0.45) DAOPNMTTAAR1PIK3CARPA1
SCHEMBL27814750 0.79 TAAR1 (0.45) DAOPNMTTAAR1PIK3CARPA1

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
CN-1668601-A N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-09-14 — — CN disclosed
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