SCHEMBL560995

SCHEMBL560995

CC(C)(O)C=Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.57
MAOB P27338 1/20 0.46
EGFR P00533 1/20 0.46
GLA P06280 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HDAC3 O15379 1/20 0.43
TNKS O95271 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL28944425 1.00 CYP2C19 (0.57) CYP2C19MAOBEGFRGLATDP1
SCHEMBL560994 1.00 CYP2C19 (0.57) CYP2C19MAOBEGFRGLATDP1
SCHEMBL7903413 0.86 CYP2C19 (0.57) CYP2C19MAOBEGFRGLATDP1
SCHEMBL9907145 0.82 CYP2C19 (0.53) CYP2C19MAOBEGFRGLATDP1
SCHEMBL15689522 0.80 CYP2C19 (0.52) CYP2C19MAOBEGFRGLATDP1
SCHEMBL9906171 0.80 CYP2C19 (0.52) CYP2C19MAOBEGFRGLATDP1
SCHEMBL28939716 0.80 CYP2C19 (0.55) CYP2C19MAOBEGFRGLATDP1
SCHEMBL26917 0.80 CYP2C19 (0.55) CYP2C19MAOBEGFRGLATDP1
SCHEMBL3340845 0.80 MAOB (0.50) CYP2C19MAOBGLATDP1ALDH1A1
SCHEMBL18903348 0.80 MAOB (0.50) CYP2C19MAOBGLATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110526802-B Monomer, polymer, negative resist composition, photomask blank, and resist pattern forming method 信越化学工业株式会社 2022-09-20 CN disclosed
CN-111263838-A Fragrance composition for inhibiting off-flavor 株式会社LG生活健康 2020-06-09 CN disclosed
CN-110526802-A Monomer, polymer, negative resist composition, photo blanks and resist pattern forming method SHINETSU CHEMICAL CO 2019-12-03 CN disclosed
US-8420698-B2 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC (US) 2013-04-16 US disclosed
US-20120035257-A1 Histone Deacetylase Inhibitors ERRANT GENE THERAPEUTICS, LLC 2012-02-09 US disclosed
US-20110287535-A1 Histone Deacetylase Inhibitors ERRANT GENE THERAPEUTICS, LLC 2011-11-24 US disclosed
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, LLC 2011-11-24 US disclosed
US-8026280-B2 For therapy of cancer, hematological disorders, e.g., hemoglobinopathies, and genetic related metabolic disorders, e.g., cystic fibrosis and adrenoleukodystrophy. ERRANT GENE THERAPEUTICS, LLC (US) 2011-09-27 US disclosed
US-7902259-B2 with zinc-binding activities; 5-phenyl-2,4,-pentadienoyl hydroxamic acid; gene expression inhibitor; anticarcinogenic, antitumor, antiprotozoa agent, viricide; hematological disorders, hemoglobinopathies, genetic related metabolic disorders, cystic fibrosis ERRANT GENE THERAPEUTICS, LLC (US) 2011-03-08 US disclosed
US-7858664-B2 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC (US) 2010-12-28 US disclosed
EP-1408946-A2 HISTONE DEACETYLASE INHIBITORS Circagen Pharmaceutical (US) 2004-04-21 EP disclosed
US-20030125306-A1 Histone deacetylase inhibitors CIRCAGEN PHARMACEUTICAL, A DELAWARE CORPORATION 2003-07-03 US disclosed
US-20030083521-A1 Such as 5-phenyl-2,4-pentadienoylhydroxamic acid; for treating cancer, hematopoiesis, and genetic metabolic disorders (cystic fibrosis and adrenoleukodystrophy) CIRCAGEN PHARMACEUTICAL, A MARYLAND CORPORATION 2003-05-01 US disclosed
US-6495719-B2 FOR USE IN THERAPY OF CANCER, HEMATOLOGICAL DISORDERS, SUCH AS HEMATOPOIESIS, AND GENETIC RELATED METABOLIC DISORDERS, SUCH AS, CYSTIC FIBROSIS AND ADRENOLEUKODYSTROPHY CIRCAGEN PHARMACEUTICAL 2002-12-17 US disclosed
WO-2002076941-A2 HISTONE DEACETYLASE INHIBITORS CIRCAGEN PHARMACEUTICAL (US) 2002-10-03 WO disclosed
US-20020143037-A1 Histone deacetylase inhibitors CIRCAGEN PHARMACEUTICAL, A DELAWARE CORPORATION 2002-10-03 US disclosed
US-20020143052-A1 Histone deacetylase inhibitors ANGELA CHEN SABELLA 2002-10-03 US disclosed
US-20020143196-A1 Histone deacetylase inhibitors ERRANT GENE THERAPEUTICS, LLC 2002-10-03 US disclosed
EP-0945420-A1 Process for the preparation of bisphenols Mitsui Chemicals, Inc. (JP) 1999-09-29 EP disclosed
US-4070374-A Process for the preparation of aryl substituted aldehydes, ketones and alcohols GIVAUDAN CORPORATION (US) 1978-01-24 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 (7 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-20120035257-A1 Histone Deacetylase Inhibitors HDAC1, HDAC11, HDAC9 CYP2C19 2302/4885MAOB 1386/4885EGFR 4173/4885
US-20030083521-A1 Such as 5-phenyl-2,4-pentadienoylhydroxamic acid; for treating cancer, hematopoiesis, and genetic metabolic disorders (cystic fibrosis and adrenoleukodystrophy) ZFX, HDAC5, ZNF277 CYP2C19 3032/4885MAOB 3351/4885EGFR 4435/4885
US-20020143052-A1 Histone deacetylase inhibitors HDAC1, HDAC11, HDAC9 CYP2C19 2560/4885MAOB 1639/4885EGFR 4280/4885
US-20030125306-A1 Histone deacetylase inhibitors HDAC1, HDAC11, HDAC9 CYP2C19 2560/4885MAOB 1639/4885EGFR 4280/4885
US-20020143196-A1 Histone deacetylase inhibitors HDAC1, HDAC11, HDAC5 CYP2C19 4041/4885MAOB 2821/4885EGFR 4554/4885
US-20020143037-A1 Histone deacetylase inhibitors HDAC1, HDAC9, HDAC11 CYP2C19 2007/4885MAOB 1235/4885EGFR 4233/4885
US-20110288168-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC6, HDAC5 CYP2C19 3448/4885MAOB 1159/4885EGFR 3976/4885

“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.