SCHEMBL339508

SCHEMBL339508

Cc1cccc(CC(N)=O)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.44
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
MAPT P10636 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
STING1 Q86WV6 1/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 2/20 0.40
PTGS2 P35354 2/20 0.40
TRPA1 O75762 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CTBP2 P56545 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
ICMT O60725 1/20 0.39
MEN1 O00255 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
Hydrochloric Acid SCHEMBL14167164 0.98 P2RX7 (0.43) P2RX7ESR1ESR2MAPTHSD17B10
SCHEMBL14764970 0.85 L3MBTL1 (0.46) MAPTALDH1A1MAPK1TDP1L3MBTL1
SCHEMBL7405623 0.84 P2RX7 (0.44) P2RX7ESR1ESR2MAPTHSD17B10
SCHEMBL158861 0.83 CTBP2 (0.55) MAPTALDH1A1GAAPTGS2CTBP2
SCHEMBL29718576 0.83 CTBP2 (0.55) MAPTALDH1A1GAAPTGS2CTBP2
SCHEMBL6990892 0.82 ALDH1A1 (0.48) MAPTHSD17B10ALDH1A1GAAPTGS2
SCHEMBL4100411 0.82 CYP3A4 (0.48) ESR1HSD17B10ALDH1A1GAANPSR1
SCHEMBL5210376 0.82 GAA (0.50) MAPTHSD17B10ALDH1A1MAPK1GAA
SCHEMBL228994 0.82 PTGS2 (0.57) ESR1ESR2MAPTGLASTING1
SCHEMBL7120045 0.82 HTT (0.38) HSD17B10ALDH1A1GAANPSR1ICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703990-B2 Process for manufacture and resolution of 2-acylamino-3-diphenylpropanoic acid Zhejiang Jiuzhous Pharmaceutical Co., Ltd. (CN) 2014-04-22 US claimed
US-20010021791-A1 Novel intermediates useful for the preparation of antihistaminic piperidine derivatives MERRELL PHARMACEUTICALS INC. 2001-09-13 US claimed
JP-H08512028-A 1996-12-17 JP claimed
EP-0705245-A1 NOVEL INTERMEDIATES FOR THE PREPARATION OF ANTIHISTAMINIC 4-DIPHENYLMETHYL/DIPHENYLMETHOXY PIPERIDINE DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1996-04-10 EP claimed
WO-1995000480-A1 NOVEL INTERMEDIATES FOR THE PREPARATION OF ANTIHISTAMINIC 4-DIPHENYLMETHYL/DIPHENYLMETHOXY PIPERIDINE DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1995-01-05 WO claimed
JP-59051207-A None JP disclosed
EP-3639914-B1 POLYMERIC MEMBRANES WITH HUMAN SKIN LIKE PERMEABILITY PROPERTIES AND USES THEREOF EMD MILLIPORE CORP (US) 2023-12-27 EP disclosed
US-11209421-B2 Cytidine deaminase expression level in cancer as a new therapeutic target CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-12-28 US disclosed
US-11155517-B2 4-substituted phenylamine derivatives and their use to protect crops by fighting undesired phytopathogenic micoorganisms PI INDUSTRIES LTD. (IN) 2021-10-26 US disclosed
EP-3639914-A1 POLYMERIC MEMBRANES WITH HUMAN SKIN LIKE PERMEABILITY PROPERTIES AND USES THEREOF EMD Millipore Corporation (US) 2020-04-22 EP disclosed
US-20190293629-A1 CYTIDINE DEAMINASE EXPRESSION LEVEL IN CANCER AS A NEW THERAPEUTIC TARGET CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-09-26 US disclosed
EP-2555857-B1 POLYMERIC MEMBRANES WITH HUMAN SKIN LIKE PERMEABILITY PROPERTIES AND USES THEREOF EMD MILLIPORE CORP (US) 2019-08-21 EP disclosed
US-6441179-B1 FOR PRODUCING ANTIALLERGY AGENTS AND BRONCHODILATORS MERRELL PHARMACEUTICALS INC. 2002-08-27 US disclosed
US-20020077482-A1 Novel intermediates useful for the preparation of antihistaminic piperidine derivatives MERRELL DOW PHARMACEUTICALS INC. 2002-06-20 US disclosed
EP-0813525-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1997-12-29 EP disclosed
WO-1996028427-A1 BENZAMIDINE DERIVATIVES THEIR PREPARATION AND THEIR USE AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1996-09-19 WO disclosed
EP-0705245-A1 NOVEL INTERMEDIATES FOR THE PREPARATION OF ANTIHISTAMINIC 4-DIPHENYLMETHYL/DIPHENYLMETHOXY PIPERIDINE DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1996-04-10 EP disclosed
EP-0700387-A1 SALTS OF SUBSTITUTED HETEROAROMATIC NITROGEN COMPOUNDS, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOUNDS CONTAINING SAME SANOFI (FR) 1996-03-13 EP disclosed
WO-1995000480-A1 NOVEL INTERMEDIATES FOR THE PREPARATION OF ANTIHISTAMINIC 4-DIPHENYLMETHYL/DIPHENYLMETHOXY PIPERIDINE DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1995-01-05 WO disclosed
JP-S5951207-A HERBICIDE FOR PADDY FIELD YASHIMA CHEM IND CO LTD 1984-03-24 JP 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-11155517-B2 4-substituted phenylamine derivatives and their use to protect crops by fighting undesired phytopathogenic micoorganisms PNMT, PAH, GNMT P2RX7 607/4885ESR1 4649/4885ESR2 4639/4885
US-20010021791-A1 Novel intermediates useful for the preparation of antihistaminic piperidine derivatives HRH1, HRH3, HRH4 P2RX7 447/4885ESR1 3791/4885ESR2 2193/4885
US-20020077482-A1 Novel intermediates useful for the preparation of antihistaminic piperidine derivatives HRH1, HRH3, HRH4 P2RX7 544/4885ESR1 4122/4885ESR2 2680/4885

“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.