SCHEMBL11363350

SCHEMBL11363350

O=C(c1ccc(Cl)c(Cl)c1)N1CCN/C1=N\c1ccc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.43
▸ PKM P14618 1/20 0.40
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ PGR P06401 3/20 0.38
▸ GPR6 P46095 1/20 0.38
▸ F2 P00734 1/20 0.37
▸ PLAU P00749 1/20 0.37
▸ KLKB1 P03952 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ GPBAR1 Q8TDU6 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ GPR183 P32249 1/20 0.34
▸ ALPL P05186 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
SCHEMBL11363360 1.00 HPGD (0.43) HPGDPKMCRHBPCRHR2PGR
SCHEMBL10831824 0.92 GPR6 (0.43) HPGDCRHBPCRHR2GPR6ALPL
SCHEMBL11371833 0.88 KCNN4 (0.42) PKM
SCHEMBL11371555 0.87 GPR183 (0.39) HPGDCRHBPCRHR2PGRGPR6
SCHEMBL11375171 0.87 POLB (0.40) CRHBPCRHR2GPR6GPBAR1
SCHEMBL11375172 0.87 POLB (0.40) CRHBPCRHR2GPR6GPBAR1
SCHEMBL11369885 0.86 TP53 (0.44) CRHBPCRHR2GPBAR1ALPL
SCHEMBL11369881 0.86 TP53 (0.44) CRHBPCRHR2GPBAR1ALPL
SCHEMBL10832211 0.85 SCN5A (0.39) CRHBPCRHR2GPR6
SCHEMBL10831627 0.84 MAPT (0.44) HPGDGPR6

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
US-4262005-A CONTROLLING ECTOPARASITES WHICH ATTACK CATTLE AND PIGS THE BOOTS COMPANY LIMITED (GB) 1981-04-14 — — US disclosed
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