SCHEMBL11010487

SCHEMBL11010487

C=C(C)C(=O)c1cc2cc(C(=O)O)oc2cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
CYP3A4 P08684 1/20 0.48
PIM1 P11309 9/20 0.42
CSNK2A1 P68400 3/20 0.42
CSNK2A2 P19784 2/20 0.42
CSNK2B P67870 2/20 0.42
CSNK2A3 Q8NEV1 2/20 0.42
TP53 P04637 1/20 0.40
PIM2 Q9P1W9 4/20 0.39
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
MAOB P27338 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 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
Furacrinic Acid SCHEMBL11008170 0.85 LMNA (0.42) LMNAMAPTCYP3A4PIM1CSNK2A1
SCHEMBL11118115 0.79 MAPT (0.36) LMNAMAPTCYP3A4CA12CA1
SCHEMBL11746037 0.79 PIM1 (0.53) LMNAMAPTCYP3A4PIM1CSNK2A1
SCHEMBL1701238 0.73 PIM1 (0.56) LMNAMAPTPIM1CSNK2A1CSNK2A2
SCHEMBL1818472 0.73 PIM1 (0.47) LMNAMAPTPIM1CSNK2A1CSNK2A2
SCHEMBL11535872 0.70 NPC1 (0.53) LMNAMAPTPIM1CSNK2A1CSNK2A2
SCHEMBL9424948 0.70 PIM1 (0.55) LMNAMAPTCYP3A4PIM1CSNK2A1
SCHEMBL11010398 0.69 LMNA (0.45) LMNAMAPTCYP3A4PIM1CSNK2A1
SCHEMBL20135967 0.69 ALDH1A1 (0.58) LMNAMAPTCYP3A4PIM1CSNK2A1
Hydrochloric Acid SCHEMBL11884345 0.68 LMNA (0.36) LMNAMAPTCYP3A4PIM1CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4552871-A ALDOSTERONE-ANTAGONISTIC, DIURETICS CIBA GEIGY CORPORATION (US) 1985-11-12 US disclosed
EP-0122882-A1 Steroids of the 20-spiroxan series, process for their preparation, pharmaceutical compositions containing them and use of these compositions CIBA-GEIGY AG (CH) 1984-10-24 EP disclosed
EP-0011818-B1 MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS BASED ON ALDOSTERONE ANTAGONISTS AND DIURETICS AND PROCESS FOR THEIR MANUFACTURE CIBA-GEIGY AG (CH) 1983-01-19 EP disclosed
US-4283407-A ANTIHYPERTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-08-11 US disclosed
US-4261985-A REDUCED EXCRETION OF POTASSIUM IONS BY INCLUSION OF ALDOSTERONE ANTAGONIST CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
EP-0011818-A1 Medicaments and pharmaceutical compositions based on aldosterone antagonists and diuretics and process for their manufacture CIBA-GEIGY AG (CH) 1980-06-11 EP disclosed
US-4075208-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1978-02-21 US disclosed
US-4075335-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1978-02-21 US disclosed
US-3956335-A HYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed