SCHEMBL512377

SCHEMBL512377

Cc1ccc(C(C)C)cc1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
GAA P10253 3/20 0.59
ALOX12 P18054 1/20 0.59
HTT P42858 1/20 0.59
HIF1A Q16665 1/20 0.59
LMNA P02545 1/20 0.58
PTGS1 P23219 2/20 0.56
TRPA1 O75762 1/20 0.56
CACNA1C Q13936 1/20 0.56
TDP1 Q9NUW8 3/20 0.52
CASP1 P29466 1/20 0.52
CYP3A4 P08684 4/20 0.48
MAPT P10636 2/20 0.43
TSHR P16473 2/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40
SCN4A P35499 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.38

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 SCHEMBL11333307 0.98 ALDH1A1 (0.57) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL4368719 0.84 ALDH1A1 (0.50) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL11804318 0.84 ALDH1A1 (0.50) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL16392261 0.84 ALDH1A1 (0.50) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL13254985 0.82 TDP1 (0.48) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL6581493 0.82 TDP1 (0.48) ALDH1A1GAAALOX12HTTHIF1A
Hydrochloric Acid SCHEMBL16370133 0.82 ALDH1A1 (0.48) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL13254987 0.82 TDP1 (0.48) ALDH1A1GAAALOX12HTTHIF1A
Hydrochloric Acid SCHEMBL16370334 0.82 ALDH1A1 (0.48) ALDH1A1GAAALOX12HTTHIF1A
Hydrochloric Acid SCHEMBL16370328 0.82 ALDH1A1 (0.48) ALDH1A1GAAALOX12HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288552-B2 Dihydropyridone amidesas P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-10-16 US claimed
EP-3792241-B1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO PERFUMERY CO LTD (JP) 2026-04-22 EP disclosed
US-20250333414-A1 HETARYL SUBSTITUTED INDAZOLES AND BENZIMIDAZOLES AS STING ANTAGONISTS AND THE USE THEREOF AS MEDICAMENT BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2025-10-30 US disclosed
EP-4460492-A1 COMPOUNDS CONTAINING A HYDROXYPHENYL MOIETY AND THEIR USE (INSERM) Institut National de la Santé et de la Recherche Médicale (FR) 2024-11-13 EP disclosed
US-11912825-B2 Polymers derived from 2,2′-bisimidazoles THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2024-02-27 US disclosed
EP-3675801-B1 ANTI-MICROBIAL PARTICLES AND METHODS OF USE THEREOF NOBIO LTD (IL) 2024-01-24 EP disclosed
EP-3814348-B9 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-11-01 EP disclosed
US-20230302142-A1 Cytotoxic Agents Pheon Therapeutics Ltd. (GB) 2023-09-28 US disclosed
WO-2023154282-A1 COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2023-08-17 WO disclosed
US-20230232831-A1 MONOTERPENOID AND PHENYLPROPANOID CARBONATE ESTERS AND METHODS OF THEIR MAKING AND USE AS REPELLENTS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2023-07-27 US disclosed
EP-0211326-B1 PRODUCTION OF GRAVURE INKS FOR ILLUSTRATIONS BAYER AG (DE) 1990-06-06 EP disclosed
EP-0271781-A2 Printing ink MOBAY CORPORATION (US) 1988-06-22 EP disclosed
US-4750935-A DYE CONTAINING POLYURETHANES MOBAY CORPORATION (US) 1988-06-14 US disclosed
US-4739042-A ESTERIFICATION OF AN HYDROXY PYRIDONE DYESTUFF WITH CARBOXYLIC PYRIDINE DYESTUFF BAYER AKTIENGESELLSCHAFT (DE) 1988-04-19 US disclosed
EP-0211325-A2 Method of making heliographic and flexographic printing inks BAYER AG (DE) 1987-02-25 EP disclosed
EP-0211326-A2 Production of gravure inks for illustrations BAYER AG (DE) 1987-02-25 EP disclosed
EP-0056475-A2 Pharmaceutical compositions MERCK PATENT GmbH (DE) 1982-07-28 EP disclosed
US-4233055-A Quaternary ammonioalkanecarboxylic acid anilides as plant growth influencing agents CIBA-GEIGY CORPORATION (US) 1980-11-11 US disclosed
US-4141718-A ANTIGROWTH AGENTS FOR PLANTS CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-4003875-A ULTRAVIOLET ABSORBERS CIBA-GEIGY CORPORATION (US) 1977-01-18 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-11912825-B2 Polymers derived from 2,2′-bisimidazoles PARG, PARN, NOP2 ALDH1A1 2052/4885GAA 2291/4885ALOX12 3267/4885
US-20250333414-A1 HETARYL SUBSTITUTED INDAZOLES AND BENZIMIDAZOLES AS STING ANTAGONISTS AND THE USE THEREOF AS MEDICAMENT STING1, MAVS, TBK1 ALDH1A1 4038/4885GAA 179/4885ALOX12 209/4885
US-20230302142-A1 Cytotoxic Agents ANXA11, ANXA5, HAX1 ALDH1A1 3438/4885GAA 3737/4885ALOX12 1529/4885
US-20230232831-A1 MONOTERPENOID AND PHENYLPROPANOID CARBONATE ESTERS AND METHODS OF THEIR MAKING AND USE AS REPELLENTS CYP51A1, CYP17A1, CYP4A11 ALDH1A1 813/4885GAA 4467/4885ALOX12 72/4885

“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.