SCHEMBL317820

SCHEMBL317820

CCCCCCC(CCCCCC)(CCCCCC)C(=O)OC(=O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ HSPD1 P10809 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ HSPE1 P61604 1/20 0.38
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ FFAR1 O14842 2/20 0.35
▸ CPT2 P23786 1/20 0.35
▸ PAM P19021 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ S1PR4 O95977 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 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
SCHEMBL819441 1.00 ALDH1A1 (0.43) ALDH1A1HSPD1BLMHSPE1MEN1
SCHEMBL42853 0.94 ALDH1A1 (0.46) ALDH1A1HSPD1BLMHSPE1MEN1
SCHEMBL3745174 0.88 ALDH1A1 (0.48) ALDH1A1BLMMEN1KMT2AHSD17B10
SCHEMBL10784353 0.85 MEN1 (0.39) MEN1KMT2ALMNANAAA
Citric Acid SCHEMBL28540921 0.83 ALDH1A1 (0.43) ALDH1A1HSPD1BLMHSPE1S1PR4
SCHEMBL120587 0.82 ALDH1A1 (0.52) ALDH1A1BLMMEN1KMT2AHSD17B10
SCHEMBL345024 0.81 PAM (0.47) ALDH1A1MEN1KMT2AHSD17B10TDP1
SCHEMBL7091543 0.81 PAM (0.47) ALDH1A1MEN1KMT2AHSD17B10TDP1
SCHEMBL28915425 0.81 PAM (0.47) ALDH1A1MEN1KMT2AHSD17B10TDP1
SCHEMBL8514388 0.81 PAM (0.47) ALDH1A1MEN1KMT2AHSD17B10TDP1

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 444 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9388293-B2 Polyvinyl chloride compositions EASTMAN CHEMICAL COMPANY (US) 2016-07-12 — — US claimed
US-9144958-B2 Sheets for use with medical containers FENWAL, INC. (US) 2015-09-29 — — US claimed
US-8814920-B2 Implantation device, method for producing and for applying the same STRYKER TRAUMA GMBH (DE) 2014-08-26 — — US claimed
US-20130137789-A1 POLYVINYL CHLORIDE COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2013-05-30 — — US claimed
US-8372912-B2 Polyvinyl chloride compositions EASTMAN CHEMICAL COMPANY (US) 2013-02-12 — — US claimed
US-7803360-B2 Water-degradable fishing lure BIOBAIT, INC. (US) 2010-09-28 — — US claimed
US-20090276036-A1 STENT TERUMO KABUSHIKI KAISHA (JP) 2009-11-05 — — US claimed
WO-2008137337-A1 WATER-DEGRADABLE FISHING LURE BIOBAIT, INC. (US) 2008-11-13 — — WO claimed
US-20080263934-A1 Water-degradable fishing lure BIO BAIT LLC 2008-10-30 — — US claimed
EP-1974756-A1 STENT TERUMO KABUSHIKI KAISHA (JP) 2008-10-01 — — EP claimed
US-5026347-A Blood bags BAXTER INTERNATIONAL INC. (US) 1991-06-25 — — US claimed
EP-0396724-A1 PLASTIC COMPOSITION WITH ANTI-HEMOLYTIC EFFECT. BAXTER INT (US) 1990-11-14 — — EP claimed
US-4954649-A ESTERIFICATION, ACETYLATION MORFLEX CHEMICAL COMPANY, INC. (US) 1990-09-04 — — US claimed
US-4931583-A PLASTICIZERS FOR MEDICAL EQUIPMENT MORFLEX CHEMICAL COMPAY, INC. (US) 1990-06-05 — — US claimed
WO-1990005496-A1 PLASTIC COMPOSITION WITH ANTI-HEMOLYTIC EFFECT BAXTER INTERNATIONAL INC. (US) 1990-05-31 — — WO claimed
US-4892967-A ACETYLTRI-N-HEXYL CITRATE, BUTYRYLTRI-N-HEXYL CITRATE MORFLEX CHEMICAL COMPANY, INC. (US) 1990-01-09 — — US claimed
US-4883905-A ESTERIFICATION OF CITRIC ACID, NONTOXIC PLASTICIZERS FOR PVC MORFLEX CHEMICAL COMPANY, INC. (US) 1989-11-28 — — US claimed
US-4870204-A ORGANIC TITANATE CATALYST MORFLEX CHEMICAL COMPANY, INC. (US) 1989-09-26 — — US claimed
US-4789700-A PVC PLASTICIZERS; HEAT RESISTANCE, NONTOXIC MORFLEX CHEMICAL COMPANY, INC. (US) 1988-12-06 — — US claimed
US-4711922-A PLASTICIZERS FOR POLYVINYL CHLORIDE MEDICAL EQUIPMENT; HEAT RESISTANCE MORFLEX CHEMICAL COMPANY, INC. (US) 1987-12-08 — — US claimed
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