SCHEMBL11510067

SCHEMBL11510067

Cc1cc(OC(=O)c2cncc(Cl)c2)n(C(C)c2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ S1PR4 O95977 2/20 0.40
▸ S1PR3 Q99500 2/20 0.40
▸ MAPT P10636 1/20 0.36
▸ EGLN1 Q9GZT9 2/20 0.35
▸ S1PR2 O95136 1/20 0.35
▸ S1PR1 P21453 1/20 0.35

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
SCHEMBL11731962 0.89 PDPK1 (0.35) —
SCHEMBL11509267 0.86 KDM4E (0.40) MAPTEGLN1
SCHEMBL11507137 0.84 PTGS1 (0.37) S1PR4S1PR3MAPTEGLN1S1PR2
SCHEMBL11507587 0.84 POLB (0.39) S1PR4S1PR3MAPTEGLN1S1PR2
SCHEMBL11509376 0.83 S1PR3 (0.43) S1PR4S1PR3MAPTEGLN1S1PR2
SCHEMBL11507933 0.83 MDM2 (0.39) S1PR3MAPTEGLN1S1PR1
SCHEMBL11508328 0.82 OGA (0.35) S1PR3MAPTEGLN1S1PR1
SCHEMBL11509813 0.82 S1PR3 (0.37) S1PR4S1PR3MAPTEGLN1S1PR2
SCHEMBL11509730 0.82 IDO1 (0.36) MAPT
SCHEMBL11507210 0.82 POLB (0.44) MAPT

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
Send feedback