SCHEMBL11511756

SCHEMBL11511756

Cc1cc(OC(=O)c2ncccc2F)n(C(C)c2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR139 Q6DWJ6 8/20 0.38
▸ PTGDR2 Q9Y5Y4 4/20 0.33
▸ HTT P42858 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ CTSA P10619 1/20 0.32

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
SCHEMBL11507489 0.84 KMT2A (0.45) GPR139HTT
SCHEMBL11507933 0.81 MDM2 (0.39) GPR139MAPTS1PR1S1PR3
SCHEMBL11509267 0.80 KDM4E (0.40) MAPT
SCHEMBL11509078 0.80 GRM4 (0.38) GPR139
SCHEMBL11509813 0.80 S1PR3 (0.37) MAPTS1PR1S1PR3
SCHEMBL11509317 0.79 EGLN1 (0.36) GPR139HTTS1PR3
SCHEMBL11507210 0.79 POLB (0.44) GPR139MAPT
SCHEMBL11509784 0.79 PTGS1 (0.38) GPR139PTGDR2HTT
SCHEMBL11510040 0.78 OGA (0.34) GPR139HTT
SCHEMBL11510264 0.78 GRM5 (0.37) GPR139MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4160098-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1979-07-03 — — US disclosed
US-4122281-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE BAYER AKTIENGESELLSCHAFT (DE) 1978-10-24 — — US disclosed
US-4122280-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE BAYER AKTIENGESELLSCHAFT (DE) 1978-10-24 — — US disclosed
US-4122279-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE BAYER AKTIENGESELLSCHAFT (DE) 1978-10-24 — — US disclosed
US-4096152-A DIURETICS, SALURETICS, HYPOTENSIVE BAYER AKTIENGESELLSCHAFT (DT) 1978-06-20 — — US disclosed
US-4069334-A DIURETICS, HYPOTENSIVES BAYER AKTIENGESELLSCHAFT (DT) 1978-01-17 — — US disclosed
US-4002641-A DIURETICS, SALURETICS, HYPOTENSIVES BAYER AKTIENGESELLSCHAFT (DT) 1977-01-11 — — US disclosed
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