SCHEMBL2627699

SCHEMBL2627699

CCCCC(CCC)C(=O)OC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.77
CA1 P00915 4/20 0.77
ZDHHC7 Q9NXF8 1/20 0.50
MAPK1 P28482 1/20 0.48
HDAC7 Q8WUI4 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC9 Q9UKV0 2/20 0.45
HDAC5 Q9UQL6 2/20 0.45
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
CHRM1 P11229 1/20 0.44
AKR1A1 P14550 1/20 0.44
CHRM3 P20309 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
ADRA1A P35348 1/20 0.44
HRH1 P35367 1/20 0.44
DRD3 P35462 1/20 0.44
SLC6A3 Q01959 1/20 0.44

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 SCHEMBL28528409 0.98 CA2 (0.74) CA2CA1ZDHHC7MAPK1HDAC7
SCHEMBL8950290 0.96 CA2 (0.83) CA2CA1ZDHHC7MAPK1TDP1
SCHEMBL3679625 0.94 CA2 (0.68) CA2CA1ZDHHC7MAPK1HDAC7
SCHEMBL21052368 0.93 CA2 (0.80) CA2CA1ZDHHC7MAPK1TDP1
Hydrochloric Acid SCHEMBL28119340 0.92 CA2 (0.66) CA2CA1ZDHHC7MAPK1HDAC7
SCHEMBL6353978 0.92 CA2 (0.66) CA2CA1ZDHHC7HDAC7HDAC8
SCHEMBL27812332 0.92 CA2 (0.66) CA2CA1ZDHHC7HDAC7HDAC8
SCHEMBL13808655 0.92 CA2 (0.66) CA2CA1ZDHHC7HDAC7HDAC8
SCHEMBL3681990 0.92 CA2 (0.66) CA2CA1ZDHHC7HDAC7HDAC8
SCHEMBL27449276 0.92 CA2 (0.66) CA2CA1ZDHHC7HDAC7HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221646-A PD-1/PD-L1 inhibitors 吉利德科学公司 2024-06-21 CN disclosed
CN-117897382-A Nitrogen-containing tricyclic compounds and pharmaceutical uses thereof 日本烟草产业株式会社 2024-04-16 CN disclosed
CN-117800975-A Compounds with anti-KRAS mutant tumor activity 泰励生物科技(上海)有限公司 2024-04-02 CN disclosed
CN-112399874-B PD-1/PD-L1 inhibitors 吉利德科学公司 2024-03-22 CN disclosed
CN-117295726-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-12-26 CN disclosed
CN-116981672-A Macrocyclic compounds as CFTR modulators 爱杜西亚药品有限公司 2023-10-31 CN disclosed
CN-115515936-A Process for the preparation of (R) -4- (1- (6- (4- (trifluoromethyl) benzyl) -6-azaspiro [2.5] octane-5-carboxamido) -cyclopropyl) benzoic acid or a salt thereof 罗达制药生物技术有限责任公司 2022-12-23 CN disclosed
CN-109952360-B Quantum dot dispersion, self-luminous photosensitive resin composition, color filter manufactured using the same, and image display device 东友精细化工有限公司 2022-03-22 CN disclosed
CN-109810589-A Light converts resin combination, light conversion layer folds substrate and image display device 东友精细化工有限公司 2019-05-28 CN disclosed
EP-2794547-B1 PROCESS FOR THE PREPARATION OF ESTERS FROM FORMATES AND COMPOUNDS OLEFINICALLY UNSATURATED EVONIK DEGUSSA GMBH (DE) 2019-02-06 EP disclosed
US-20080045490-A1 Pharmaceutical Compositions BIOVIE INC. 2008-02-21 US disclosed
US-20070275936-A1 Formulations and Treatment Methods BIOVIE INC. 2007-11-29 US disclosed
US-20070275936-A1 Formulations and Treatment Methods BIOVIE INC. 2007-11-29 US disclosed
US-20070129282-A1 Pharmaceutical treatments and compositions BIOVIE INC. 2007-06-07 US disclosed
US-20070129282-A1 Pharmaceutical treatments and compositions BIOVIE INC. 2007-06-07 US disclosed
US-6207739-B1 Polyamide acid composition containing metal, polyimide film, flexible printed wiring board and method for producing them KANEGAFUCHI KAGAKU KOGYO KABUSHIKI (JP) 2001-03-27 US disclosed
CN-1284942-A matrix metalloproteinase inhibitors PFIZER LTD (US) 2001-02-21 CN disclosed
US-5463095-A Process for the production of esters MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-10-31 US disclosed
EP-0629603-A1 Process for the production of esters MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-12-21 EP disclosed
CN-1060285-A The fused ring analogs of nitrogenous nonaromatic heterocycles PFIZER (US) 1992-04-15 CN 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-20080045490-A1 Pharmaceutical Compositions HSD3B1, HSD17B3, HSD17B1 CA2 3762/4885CA1 3617/4885ZDHHC7 634/4885
US-20070129282-A1 Pharmaceutical treatments and compositions HSD3B1, HSD3B2, HSD17B1 CA2 3601/4885CA1 3803/4885ZDHHC7 483/4885
US-20070275936-A1 Formulations and Treatment Methods HSD3B1, HSD17B1, HSD17B3 CA2 3848/4885CA1 3817/4885ZDHHC7 388/4885

“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.