SCHEMBL3280107

SCHEMBL3280107

CC(C)(C)Oc1cccc(C=O)n1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 1/20 0.40
CCR1 P32246 1/20 0.36
TERT O14746 11/20 0.36
FFAR4 Q5NUL3 1/20 0.34
ALDH1A1 P00352 2/20 0.33
IDH1 O75874 1/20 0.32
KCNH2 Q12809 1/20 0.32
FGFR4 P22455 1/20 0.32

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
SCHEMBL31038558 1.00 TRPV3 (0.40) TRPV3CCR1TERTFFAR4ALDH1A1
SCHEMBL25236473 0.81 TERT (0.39) CCR1TERTALDH1A1IDH1
SCHEMBL1476989 0.81 TRPV3 (0.40) TRPV3KCNH2
SCHEMBL2522651 0.80 TRPV3 (0.45) TRPV3FFAR4ALDH1A1KCNH2
SCHEMBL29432664 0.79 IDH1 (0.47) CCR1TERTALDH1A1IDH1
SCHEMBL506568 0.79 IDH1 (0.47) CCR1TERTALDH1A1IDH1
SCHEMBL5799300 0.77 CA12 (0.37) CCR1TERTALDH1A1IDH1
SCHEMBL29432773 0.74 BTK (0.49) CCR1TERTALDH1A1
SCHEMBL594437 0.74 ALDH1A3 (0.40) CCR1TERTALDH1A1
SCHEMBL29432650 0.74 ALDH1A3 (0.40) CCR1TERTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271299-A Lactam compound, and preparation method and application thereof 广州市联瑞制药有限公司 2024-07-02 CN disclosed
US-9012651-B2 TRPV3 modulators ABBVIE INC. (US) 2015-04-21 US disclosed
US-8673924-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2014-03-18 US disclosed
US-8673924-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2014-03-18 US disclosed
US-8586576-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-19 US disclosed
US-8580782-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-12 US disclosed
US-8580782-B2 Substituted pyrazolo[1,5-a]pyrimidines as cyclin dependent kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-12 US disclosed
US-8569317-B2 Aryl-quinazoline/aryl-2amino-phenyl methanone derivatives NOVARTIS AG (CH) 2013-10-29 US disclosed
US-8569317-B2 Aryl-quinazoline/aryl-2amino-phenyl methanone derivatives NOVARTIS AG (CH) 2013-10-29 US disclosed
US-20120245124-A1 TRPV3 Modulators ABBOTT LABORATORIES (US) 2012-09-27 US disclosed
EP-1585521-A2 DERIVATIVES OF ARYL-QUINAZOLINE/ARYL-2AMINO-PHENYL METHANONE WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2005-10-19 EP disclosed
US-20050182053-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-08-18 US disclosed
WO-2005056562-A1 SUBSTITUTED 3-AMINO-THIENO[2,3-B] PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AS IKK INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-06-23 WO disclosed
WO-2004056365-A2 DERIVATIVES OF ARYL-QUINAZOLINE/ARYL-2AMINO-PHENYL METHANONE WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE NOVARTIS AG (CH) 2004-07-08 WO disclosed
CN-1089338-C Pyridine derivatives as fungicides ZENECA LTD (GB) 2002-08-21 CN disclosed
US-6169101-B1 FUNGICIDES ZENECA LIMITED (GB) 2001-01-02 US disclosed
EP-0882019-B1 PYRIDINE DERIVATIVES AS FUNGICIDES ZENECA LTD (GB) 2000-07-05 EP disclosed
CN-1210519-A Pyridine derivatives as fungicides ZENECA LTD (GB) 1999-03-10 CN disclosed
EP-0882019-A1 PYRIDINE DERIVATIVES AS FUNGICIDES ZENECA LIMITED (GB) 1998-12-09 EP disclosed
WO-1997029088-A1 PYRIDINE DERIVATIVES AS FUNGICIDES ZENECA LIMITED (GB) 1997-08-14 WO 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 (2 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-20050182053-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, IKBKG, IKBKE TRPV3 3910/4885CCR1 1277/4885TERT 1595/4885
US-20120245124-A1 TRPV3 Modulators TRPV3, TRPV2, TRPV1 TRPV3 1/4885CCR1 1146/4885TERT 4600/4885

“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.