SCHEMBL3715355

SCHEMBL3715355

O=C(CBr)Nc1cccc(Br)c1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.72
ALDH1A1 P00352 4/20 0.62
HPGD P15428 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.57
MAOA P21397 1/20 0.57
MAOB P27338 1/20 0.57
TGM2 P21980 1/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HTT P42858 1/20 0.56
ATM Q13315 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.55
RAB9A P51151 1/20 0.54
MAPT P10636 2/20 0.54
P2RX1 P51575 1/20 0.53

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
SCHEMBL5142687 0.89 GAA (0.77) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL21765844 0.88 POLB (0.56) GAAALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL28627031 0.85 GAA (0.72) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL28712302 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL29678198 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL15145824 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL5690831 0.84 GAA (1.00) GAAALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL27641820 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL29388992 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA
SCHEMBL4011436 0.84 GAA (0.70) GAAALDH1A1HPGDSMN1; SMN2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114716344-B 2- ((2-acetamidophenyl) amino) acetamido compound and preparation method and application thereof 湖南科技大学 2023-12-22 CN disclosed
CN-114716344-A 2- ((2-acetamidophenyl) amino) acetyl arylamine compound and preparation method and application thereof 湖南科技大学 2022-07-08 CN disclosed
CN-113292523-A Selective butyrylcholine esterase inhibitor or medicinal salt thereof, and preparation method and application thereof 中国药科大学 2021-08-24 CN disclosed
US-8758935-B2 Soluble polymer with multi-stable electric states and products comprising such polymer NATIONAL UNIVERSITY OF SINGAPORE (SG) 2014-06-24 US disclosed
US-20110294976-A1 SOLUBLE POLYMER WITH MULTI-STABLE ELECTRIC STATES AND PRODUCTS COMPRISING SUCH POLYMER National University of Singpore (SG) 2011-12-01 US disclosed
WO-2010090603-A1 SOLUBLE POLYMER WITH MULTI-STABLE ELECTRIC STATES AND PRODUCTS COMPRISING SUCH POLYMER NATIONAL UNIVERSITY OF SINGAPORE (SG) 2010-08-12 WO disclosed
EP-1542869-A2 MOLECULAR SCALE ELECTRONIC DEVICES Yale University (US) 2005-06-22 EP disclosed
EP-1542869-A4 MOLECULAR SCALE ELECTRONIC DEVICES UNIV YALE (US) 2005-06-22 EP disclosed
US-20050101063-A1 Three-terminal field-controlled molecular devices TOUR JAMES M (US) 2005-05-12 US disclosed
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
WO-2001027972-A2 MOLECULAR SCALE ELECTRONIC DEVICES YALE UNIVERSITY (US) 2001-04-19 WO disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed
EP-0222576-B1 HETEROCYCLIC OXOPHTHALAZINYL ACETIC ACIDS PFIZER INC. (US) 1992-03-18 EP disclosed
US-4939140-A ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1990-07-03 US disclosed
EP-0222576-A2 Heterocyclic oxophthalazinyl acetic acids PFIZER INC. (US) 1987-05-20 EP disclosed
EP-0023557-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED NITROARYL COMPOUNDS CIBA-GEIGY AG (CH) 1984-08-01 EP disclosed
US-4339618-A Process for the production of substituted nitroaryl compounds CIBA-GEIGY AG (CH) 1982-07-13 US disclosed
EP-0023557-A1 Process for the preparation of substituted nitroaryl compounds CIBA-GEIGY AG (CH) 1981-02-11 EP 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 (1 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-20110294976-A1 SOLUBLE POLYMER WITH MULTI-STABLE ELECTRIC STATES AND PRODUCTS COMPRISING SUCH POLYMER EPCAM, CD44, DCX GAA 3911/4885ALDH1A1 2819/4885HPGD 3897/4885

“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.