SCHEMBL3199664

SCHEMBL3199664

Cc1cccc(NCCC(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
CYP1A2 P05177 2/20 0.67
CYP3A4 P08684 2/20 0.67
CYP2C19 P33261 2/20 0.67
HTT P42858 2/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C9 P11712 1/20 0.67
HSD17B10 Q99714 2/20 0.51
GAA P10253 1/20 0.50
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 2/20 0.49
HDAC3 O15379 2/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC2 Q92769 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
MEN1 O00255 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
SCHEMBL9951091 0.87 GAA (0.60) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL27823612 0.86 MAPT (0.67) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL4862020 0.85 MAPT (0.65) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL11121780 0.83 MAPT (0.62) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL9468482 0.83 MAPT (0.62) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL27823621 0.83 MAPT (0.62) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL4805587 0.82 MAPT (0.60) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL5992633 0.82 KMT2A (0.53) MAPTHTTHSD17B10GAAALDH1A1
SCHEMBL8373327 0.81 MAPT (1.00) MAPTCYP1A2CYP3A4CYP2C19HTT
SCHEMBL9752202 0.81 CYP1A2 (0.59) MAPTCYP1A2CYP3A4CYP2C19HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101058558-A 4-Oxy-1(4H)-quinoline carboxylic acids compound and composition with aldose reductase inhibition activity and preparation method thereof UNIV SHENYANG PHARMACEUTICAL (CN) 2007-10-24 CN claimed
WO-2021053495-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-03-25 WO disclosed
CN-104350106-B Comprise the laundry care composition of dyestuff 宝洁公司 2017-03-08 CN disclosed
US-8937090-B2 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO COMPANY, LTD. (JP) 2015-01-20 US 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-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-5520883-A OPTICAL DETECTION WITH CARRIER MATRIX AND GLUCOSE BORONATE MILES INC. (US) 1996-05-28 US disclosed
EP-0316762-B1 TEST DEVICES FOR DETERMINATION OF OCCULT BLOOD AND GLUCOSE MILES INC. (US) 1992-04-22 EP disclosed
US-4895798-A GLUCOSE OXIDATES, GLUCOSE DERIVATIVE MILES, INC. (US) 1990-01-23 US disclosed
EP-0316762-A1 Test devices for determination of occult blood and glucose MILES INC. (US) 1989-05-24 EP disclosed
EP-0140337-B1 MULTIZONE ELEMENT AND METHOD FOR ANALYSIS OF WHOLE BLOOD EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-04-19 EP disclosed
US-H600-H SPECTROPHOTOMETRY FUJI PHOTO FILM CO., LTD. (JP) 1989-03-07 US disclosed
US-4637978-A MULTIZONAL, SPECTROPHOTOMETRY, COLORS/MATERIALS; SPREADING, POROSITY EASTMAN KODAK COMPANY (US) 1987-01-20 US disclosed
EP-0140337-A2 Multizone element and method for analysis of whole blood EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-05-08 EP disclosed
US-4508902-A OXIDATION OF 1,2,3,4-TETRAHYDROQUINOLINE-4-ONES RHONE-POULENC SANTE (FR) 1985-04-02 US disclosed
US-4412075-A Process for the preparation of quinolin-4-ones RHONE-POULENC SANTE (FR) 1983-10-25 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 (3 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 MAPT 2499/4885CYP1A2 3833/4885CYP3A4 4513/4885
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin CUTA, AAAS, NUP160 MAPT 2324/4885CYP1A2 3980/4885CYP3A4 4084/4885
US-20120165409-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 MAPT 2212/4885CYP1A2 3658/4885CYP3A4 4511/4885

“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.