SCHEMBL11373206

SCHEMBL11373206

O=C(OCc1ccccc1)N1CCN/C1=N\c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.43
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ AVPR1A P37288 1/20 0.41
▸ GRM5 P41594 1/20 0.41
▸ XIAP P98170 1/20 0.40
▸ BIRC2 Q13490 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PTGDR2 Q9Y5Y4 2/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ SLC6A12 P48065 1/20 0.36

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
SCHEMBL11373210 1.00 GAA (0.43) GAANPC1RAB9AL3MBTL1AVPR1A
SCHEMBL11361387 0.86 KMT2A (0.46) GAARAB9AL3MBTL1SMN1; SMN2CRHBP
SCHEMBL11361383 0.86 KMT2A (0.46) GAARAB9AL3MBTL1SMN1; SMN2CRHBP
SCHEMBL11371824 0.84 AVPR1A (0.43) AVPR1AGRM5CRHBPCRHR2MEN1
SCHEMBL11371825 0.84 AVPR1A (0.43) AVPR1AGRM5CRHBPCRHR2MEN1
SCHEMBL11366220 0.83 MEN1 (0.39) RAB9AL3MBTL1CRHBPCRHR2MEN1
SCHEMBL11366217 0.83 MEN1 (0.39) RAB9AL3MBTL1CRHBPCRHR2MEN1
SCHEMBL11365870 0.82 CRHBP (0.41) GAANPC1RAB9AAVPR1ASMN1; SMN2
SCHEMBL11365865 0.82 CRHBP (0.41) GAANPC1RAB9AAVPR1ASMN1; SMN2
SCHEMBL11372535 0.82 KIT (0.39) GAARAB9ACRHBPCRHR2MEN1

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
Send feedback