SCHEMBL3203778

SCHEMBL3203778

COc1ccc(NCCC(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
MAPT P10636 4/20 0.66
GAA P10253 3/20 0.66
FFAR1 O14842 1/20 0.63
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 4/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PDE4B Q07343 1/20 0.51
KDM4E B2RXH2 1/20 0.51
HTT P42858 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HIF1A Q16665 1/20 0.50
LMNA P02545 2/20 0.49

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
SCHEMBL2677428 0.90 GAA (0.61) POLBMAPTGAAFFAR1TDP1
SCHEMBL11116977 0.87 GAA (0.58) POLBMAPTGAAFFAR1TDP1
SCHEMBL30819407 0.86 MAPT (0.66) POLBMAPTGAAFFAR1ALDH1A1
SCHEMBL28470217 0.86 MAPT (0.66) POLBMAPTGAAFFAR1ALDH1A1
SCHEMBL4715503 0.84 POLB (0.50) POLBMAPTGAAFFAR1TDP1
SCHEMBL10423768 0.83 PDE4B (0.57) POLBMAPTGAAFFAR1TDP1
SCHEMBL27966155 0.83 MAPT (0.61) POLBMAPTGAAFFAR1ALDH1A1
SCHEMBL3200689 0.83 POLB (0.59) POLBMAPTGAATDP1ALDH1A1
SCHEMBL1797197 0.81 MAPT (0.59) POLBMAPTGAAFFAR1ALDH1A1
Hydrochloric Acid SCHEMBL3655605 0.81 MAPT (0.59) POLBMAPTGAAFFAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117069658-A Preparation method of 4-oxo-6-methoxy-3- (2, 3-dichlorophenyl) methyl-1 (4H) -quinolineacetic acid 宁夏康亚药业股份有限公司 2023-11-17 CN disclosed
WO-2023023531-A1 ESTROGEN RECEPTOR DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2023-02-23 WO disclosed
WO-2023023531-A1 ESTROGEN RECEPTOR DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2023-02-23 WO disclosed
US-8937090-B2 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO COMPANY, LTD. (JP) 2015-01-20 US disclosed
US-20130005710-A1 AMINOPYRIDINE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-01-03 US disclosed
EP-2502909-A1 AMINOPYRIDINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2012-09-26 EP disclosed
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin SHISEIDO COMPANY, LTD. (JP) 2012-09-13 US disclosed
US-20120165409-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2012-06-28 US disclosed
US-20100035881-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2010-02-11 US disclosed
EP-1941861-A1 WRINKLE-IMPROVING AGENT Shiseido Company, Limited (JP) 2008-07-09 EP disclosed
EP-1880711-A1 PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT AND EXTERNAL COMPOSITION FOR SKIN Shiseido Company, Limited (JP) 2008-01-23 EP disclosed
WO-2000021949-A1 QUINOLONES AS T-RNA SYNTHETASE INHIBITORS AND ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM PLC (GB) 2000-04-20 WO disclosed
US-4585867-A Process for the preparation of 4-quinolinones RHONE-POULENC SANTE (FR) 1986-04-29 US disclosed

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

For each of this compound's patents that has machine-readable text (4 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-20100035881-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 POLB 1408/4885MAPT 2499/4885GAA 43/4885
US-20130005710-A1 AMINOPYRIDINE DERIVATIVE DCX, NR0B1, NR4A1 POLB 1616/4885MAPT 918/4885GAA 4837/4885
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin CUTA, AAAS, NUP160 POLB 1724/4885MAPT 2324/4885GAA 486/4885
US-20120165409-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 POLB 882/4885MAPT 2212/4885GAA 40/4885

“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.