SCHEMBL1641740

SCHEMBL1641740

O=C(O)CC(CC(=O)O)(OC(=O)C(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CYP2C19 P33261 2/20 0.40
HIF1A Q16665 2/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
ACLY P53396 3/20 0.34
CPT2 P23786 2/20 0.33
KDM4E B2RXH2 1/20 0.31
FFAR1 O14842 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL27415345 0.97 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1641737 0.90 ALDH1A1 (0.39) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1270962 0.86 CYP2C19 (0.39) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL14764308 0.84 ALDH1A1 (0.34) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL5809750 0.84 ALDH1A1 (0.42) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1547881 0.84 CYP2C19 (0.46) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL21647263 0.83 ALDH1A1 (0.46) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1230538 0.83 ALDH1A1 (0.38) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL18236487 0.83 ALDH1A1 (0.33) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL8762186 0.82 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200197310-A1 Technology for Preparation of Macromolecular Microspheres NEXBIO, INC. 2020-06-25 US disclosed
US-10583086-B2 Technology for preparation of macromolecular microspheres ANSUN BIOPHARMA, INC. (US) 2020-03-10 US disclosed
US-10231938-B2 Transdermal drug delivery device including an occlusive backing NOVEN PHARMACEUTICALS, INC. (US) 2019-03-19 US disclosed
US-20180071219-A1 Technology for Preparation of Macromolecular Microspheres NEXBIO, INC. 2018-03-15 US disclosed
US-20180028449-A1 Technology for the Preparation of Microparticles NEXBIO, INC. 2018-02-01 US disclosed
US-20170079920-A1 Technology for the Preparation of Microparticles NEXBIO, INC. 2017-03-23 US disclosed
US-20160235675-A1 Technology for the Preparation of Microparticles NEXBIO, INC. 2016-08-18 US disclosed
EP-1807033-B1 TRANSDERMAL DRUG DELIVERY DEVICE INCLUDING AN OCCLUSIVE BACKING NOVEN PHARMA (US) 2016-07-20 EP disclosed
US-20160128949-A1 TRANSDERMAL DRUG DELIVERY DEVICE INCLUDING AN OCCLUSIVE BACKING NOVEN PHARMACEUTICALS, INC. (US) 2016-05-12 US disclosed
US-20150359746-A1 Technology for the Preparation of Microparticles NEXBIO, INC. 2015-12-17 US disclosed
EP-0679084-A1 HYDANTOIN AND SUCCINIMIDE-SUBSTITUTED DERIVATIVES OF SPIROINDANYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS MERCK & CO. INC. (US) 1995-11-02 EP disclosed
US-5460605-A Diagnosis, evaluation and treatment of coronary artery disease by exercise simulation using closed loop drug delivery of an exercise simulating agent beta agonist GENSIA, INC. (US) 1995-10-24 US disclosed
WO-1994014438-A1 HYDANTOIN AND SUCCINIMIDE-SUBSTITUTED DERIVATIVES OF SPIROINDANYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1994-07-07 WO disclosed
US-5137904-A Useful in the treatment of atherosclerosis and thrombosis G. D. SEARLE & CO. (US) 1992-08-11 US disclosed
EP-0486280-A2 Piperidinylcamphorsulfonyl oxytocin antagonists MERCK & CO. INC. (US) 1992-05-20 EP disclosed
WO-1992007821-A1 DIASTEREOISOMERS OF BICYCLO-SUBSTITUTED PHENYLACETONITRILE DERIVATIVES G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed
US-5045273-A Using ketonic(or hydroxy) carbonic acid SIEMENS AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed
EP-0188386-A2 Gold electroplating bath ENGELHARD CORPORATION (US) 1986-07-23 EP disclosed
US-4493754-A USING FERRITE ANODE AT&T BELL LABORATORIES (US) 1985-01-15 US disclosed
US-4038283-A ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1977-07-26 US disclosed