SCHEMBL11507274

SCHEMBL11507274

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

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 4/20 0.38
▸ SLC6A2 P23975 2/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ GPR139 Q6DWJ6 2/20 0.36
▸ KCNJ6 P48051 1/20 0.35
▸ KCNJ5 P48544 1/20 0.35
▸ KCNJ3 P48549 1/20 0.35
▸ EGLN1 Q9GZT9 2/20 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
SCHEMBL11507688 0.92 GPR139 (0.38) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11510661 0.88 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11507580 0.88 ALDH1A1 (0.43) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11509784 0.88 PTGS1 (0.38) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11507252 0.86 ALDH1A1 (0.39) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11509837 0.86 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11507289 0.86 KCNJ6 (0.36) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11507530 0.85 PTGS1 (0.36) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11510252 0.84 SLC6A2 (0.38) SLC6A3SLC6A2SLC6A4ALDH1A1LMNA
SCHEMBL11509317 0.84 EGLN1 (0.36) SLC6A3ALDH1A1LMNAHTTSMN1; SMN2

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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