SCHEMBL11510040

SCHEMBL11510040

Cc1cc(OC(=O)c2ccc(F)s2)n(C(C)c2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 1/20 0.34
▸ PDE2A O00408 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ TMPRSS15 P98073 1/20 0.32
▸ GPR139 Q6DWJ6 3/20 0.31
▸ EGLN1 Q9GZT9 2/20 0.31
▸ SLC6A3 Q01959 2/20 0.31
▸ PSEN1 P49768 1/20 0.31
▸ PSEN2 P49810 1/20 0.31
▸ APH1B Q8WW43 1/20 0.31
▸ NCSTN Q92542 1/20 0.31
▸ APH1A Q96BI3 1/20 0.31
▸ PSENEN Q9NZ42 1/20 0.31
▸ APP P05067 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL11507933 0.82 MDM2 (0.39) PTGS1GPR139EGLN1SLC6A3PSEN1
SCHEMBL11509784 0.81 PTGS1 (0.38) OGAPTGS1GPR139EGLN1SLC6A3
SCHEMBL11507137 0.79 PTGS1 (0.37) OGAPTGS1GPR139EGLN1SLC6A3
SCHEMBL11509267 0.79 KDM4E (0.40) EGLN1SLC6A3ALDH1A1LMNASMN1; SMN2
SCHEMBL11509078 0.79 GRM4 (0.38) PTGS1GPR139EGLN1ALDH1A1
SCHEMBL11509813 0.79 S1PR3 (0.37) OGAEGLN1
SCHEMBL11509317 0.79 EGLN1 (0.36) OGAPDE2APTGS1GPR139EGLN1
SCHEMBL11507274 0.79 SLC6A3 (0.38) PTGS1GPR139EGLN1SLC6A3ALDH1A1
SCHEMBL11510661 0.79 SLC6A3 (0.38) PTGS1GPR139EGLN1SLC6A3ALDH1A1
SCHEMBL11507580 0.79 ALDH1A1 (0.43) PTGS1GPR139EGLN1SLC6A3ALDH1A1

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-4122279-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-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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