SCHEMBL9764588

SCHEMBL9764588

CCOC(=O)CC(O)CCCCCCCCC(C)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ GPR84 Q9NQS5 4/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10506484 0.81 GPR84 (0.53) TSHRALDH1A1GPR84KMT2A
SCHEMBL1866738 0.81 CYP2D6 (0.47) TSHRCYP2D6ALDH1A1L3MBTL1NPSR1
SCHEMBL21552018 0.78 GPR84 (0.46) ALDH1A1GPR84L3MBTL1KMT2A
SCHEMBL21552037 0.78 GPR84 (0.46) ALDH1A1GPR84L3MBTL1KMT2A
SCHEMBL22677576 0.78 GPR84 (0.46) ALDH1A1GPR84L3MBTL1KMT2A
SCHEMBL21551861 0.78 GPR84 (0.46) ALDH1A1GPR84L3MBTL1KMT2A
SCHEMBL7603328 0.78 GPR84 (0.46) ALDH1A1GPR84L3MBTL1KMT2A
SCHEMBL11218217 0.77 ALDH1A1 (0.43) TSHRALDH1A1L3MBTL1NPSR1KMT2A
SCHEMBL6564298 0.76 L3MBTL1 (0.42) TSHRCYP2D6ALDH1A1L3MBTL1NPSR1
SCHEMBL21551847 0.76 GPR84 (0.47) TSHRALDH1A1GPR84L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5041694-A Substituted glutaric acid lactones in the treatment of hyperlipidemia G. D. SEARLE & CO. (US) 1991-08-20 — — US claimed
US-5041694-A Substituted glutaric acid lactones in the treatment of hyperlipidemia G. D. SEARLE & CO. (US) 1991-08-20 — — US disclosed
US-4965373-A Substituted glutaric acid lactones in the treatment of hyperlipidemia G. D. SEARLE & CO. (US) 1990-10-23 — — US disclosed
US-4895973-A Substituted glutaric acid lactones in the treatment of hyperlipidemia G. D. SEARLE & COMPANY (US) 1990-01-23 — — US disclosed
EP-0194610-B1 SUBSTITUTED GLUTARIC ACID LACTONES IN THE TREATMENT OF HYPERLIPIDEMIA G.D. Searle & Co. (US) 1989-02-22 — — EP disclosed
US-4622338-A Substituted glutaric acid lactones in the treatment of hyperlipidemia G. D. SEARLE & CO. (US) 1986-11-11 — — US disclosed
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