SCHEMBL192371

SCHEMBL192371

O=C(O)CCC(C(=O)OC(=O)C(CCC(=O)O)c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
CPA3 P15088 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
CHRM1 P11229 1/20 0.42
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EPHX1 P07099 1/20 0.41
KMT2A Q03164 1/20 0.40
FFAR1 O14842 1/20 0.40
KEAP1 Q14145 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL9435439 0.87 L3MBTL1 (0.42) CYP1A2CYP2C19ALDH1A1CPA3NAALAD2
SCHEMBL3263344 0.86 TBXAS1 (0.51) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL1595458 0.86 TBXAS1 (0.51) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL7980726 0.86 KMT2A (0.55) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL9541921 0.84 USP5 (0.51) CYP2D6CYP1A2SMN1; SMN2FFAR1KDM4E
SCHEMBL10587417 0.84 MMP8 (0.50) TSHRCHRM1SMN1; SMN2KMT2AKDM4E
SCHEMBL9541600 0.84 CYP2C9 (0.44) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL2303442 0.82 KMT2A (0.49) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL652523 0.82 CYP2C19 (0.53) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL27491825 0.82 CYP2C19 (0.53) CYP2D6CYP1A2CYP2C19ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4201922-A1 METHOD FOR PURIFYING WASTED SOLUTION COMPRISING N-METHYL-2-PYRROLIDONE JAEWON INDUSTRIAL CO., LTD (KR) 2023-06-28 EP claimed
US-20230192609-A1 METHOD FOR PURIYFING WASTE N-METHYL-2-PYRROLIDONE JAEWON INDUSTRIAL CO., LTD (KR) 2023-06-22 US claimed
US-20180277766-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE ORGANIC LIGHT EMITTING DIODE HAVING HOST MATRIX POLARITY CO-DOPING DOW GLOBAL TECHNOLOGIES LLC 2018-09-27 US claimed
US-9403951-B2 Flame-retardant polyester ETERNAL MATERIALS CO., LTD. (TW) 2016-08-02 US claimed
US-20150291740-A1 FLAME-RETARDANT POLYESTER ETERNAL MATERIALS CO., LTD. (TW) 2015-10-15 US claimed
EP-1877483-B1 METHOD FOR PRODUCING CURE SYSTEM, ADHESIVE SYSTEM, AND ELECTRONIC DEVICE MOMENTIVE PERFORMANCE MAT INC (US) 2013-05-08 EP claimed
EP-2264097-B1 Method for producing cure system, adhesive system, and electronic device MOMENTIVE PERFORMANCE MAT INC (US) 2013-05-08 EP claimed
US-20120283089-A1 ZIEGLER-NATTA CATALYST FOR OLEFIN POLYMERIZATION HYOSUNG CORPORATION (KR) 2012-11-08 US claimed
EP-2520594-A2 ZIEGLER-NATTA CATALYST FOR OLEFIN POLYMERIZATION Hyosung Corporation (KR) 2012-11-07 EP claimed
US-20120171397-A1 Keto Acid Esters As PVC Plasticizers EXXONMOBIL CHEMICAL PATENTS INC. 2012-07-05 US claimed
EP-1276165-A1 Nonaqueous secondary cell Japan Storage Battery Co., Ltd. (JP) 2003-01-15 EP claimed
US-6500933-B1 STABILIZATION OF GLYCOPROTEINS SUCH AS LIPASE OR OXIDASE VIA CRYSTALLIZATION AND CARBOHYDRATE-TO-CARBOHYDRATE CROSSLINKING WITHIN THE CRYSTAL LATTICE, USING TWO DIFFERENT CROSSLINKING AGENTS; VARIOUS MEDICAL, COSMETIC AND INDUSTRIAL USES ALTUS BIOLOGICS INC. 2002-12-31 US claimed
US-20020137899-A1 Crosslinked through one or more carbohydrate moieties in said glycoprotein; storage stability, chemical stability over wider range of conditions while retaining bioactivity in use ALTUS BIOLOGICS INC. 2002-09-26 US claimed
US-6359118-B2 STABLITY; USEFUL IN DRUGS, VACCINES, PERSONAL CARE/COSMETICS, VETERINARY DRUGS/VACCINES, FOODS, FEEDS, DIAGNOSTICS, CLEANING AGENTS (DETERGENTS AND DECONTAMINANTS); CATALYTIC AND BINDING COMPONENTS OF BIOSENSORS ALTUS BIOLOGIES, INC. 2002-03-19 US claimed
US-20010008934-A1 CARBOHYDRATE CROSSLINKED GLYCOPROTEIN CRYSTALS ALTHEA TECHNOLOGIES, INC. 2001-07-19 US claimed
US-6180739-B1 CYCLODEXTRINS WITH ACRYLATE AND ANHYDRIDES AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION 2001-01-30 US claimed
EP-1009759-A1 CARBOHYDRATE CROSSLINKED GLYCOPROTEIN CRYSTALS Altus Biologics Inc. (US) 2000-06-21 EP claimed
US-5929131-A Polymerizable cyclodextrin derivatives AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1999-07-27 US claimed
WO-1999012959-A1 CARBOHYDRATE CROSSLINKED GLYCOPROTEIN CRYSTALS ALTUS BIOLOGICS INC. (US) 1999-03-18 WO claimed
US-5792821-A Polymerizable cyclodextrin derivatives AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1998-08-11 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230192609-A1 METHOD FOR PURIYFING WASTE N-METHYL-2-PYRROLIDONE NPEPPS, AZI2, ALKBH2 CYP2D6 2671/4885CYP1A2 1416/4885CYP2C19 2123/4885
US-20120171397-A1 Keto Acid Esters As PVC Plasticizers KDM7A, FFAR2, KDM4A CYP2D6 1190/4885CYP1A2 562/4885CYP2C19 438/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.