SCHEMBL17356166

SCHEMBL17356166

CC(C)c1cccc(OC(F)F)n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.36
PDE10A Q9Y233 1/20 0.35
HCRTR1 O43613 2/20 0.33
HCRTR2 O43614 2/20 0.33
DGKZ Q13574 1/20 0.33
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
HSD11B1 P28845 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
CHRNA7 P36544 1/20 0.30

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
SCHEMBL26564826 0.89 PGK1 (0.32) PGK1PGK2TAAR1CHRNA7
SCHEMBL27929264 0.85 MBOAT4 (0.35) MBOAT4PDE10AHCRTR1HCRTR2DGKZ
SCHEMBL17658867 0.84 MCHR1 (0.36) TAAR1
SCHEMBL22181485 0.82 PDE10A (0.37) MBOAT4PDE10AHCRTR1HCRTR2DGKZ
SCHEMBL19121330 0.81 CHRNA7 (0.33) TAAR1CHRNA7
SCHEMBL17658875 0.81 MCHR1 (0.39) TAAR1CHRNA7
SCHEMBL22181777 0.80 PDE10A (0.39) MBOAT4PDE10AHCRTR1HCRTR2DGKZ
SCHEMBL17658874 0.78 MCHR1 (0.41)
SCHEMBL179528 0.78 TAAR1 (0.42) TAAR1
SCHEMBL24768969 0.77 PDE8A (0.38) PGK1PGK2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787810-B2 Diacylglyceride O-acyltransferase 2 inhibitors MERCK SHARP & DOHME LLC (US) 2023-10-17 US disclosed
US-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity ANNAPURNA BIO, INC. (US) 2023-08-15 US disclosed
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2023-02-23 US disclosed
US-11326165-B1 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2022-05-10 US disclosed
US-20210363147-A1 NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2021-11-25 US disclosed
US-20210053936-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. 2021-02-25 US disclosed
US-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2020-07-02 US disclosed
US-10221162-B2 Triazole agonists of the APJ receptor AMGEN INC. (US) 2019-03-05 US disclosed
US-9695198-B2 Factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2017-07-04 US disclosed
US-20150368269-A1 Factor IXa Inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-24 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 (9 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-11724997-B2 Compounds and compositions for treating conditions associated with APJ receptor activity APLNR, AGTR1, AGTR2 MBOAT4 2947/4885PDE10A 1592/4885HCRTR1 347/4885
US-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE RORA, RORC, RORB MBOAT4 3267/4885PDE10A 2092/4885HCRTR1 334/4885
US-20210053936-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY APLNR, AGTR1, AGTR2 MBOAT4 2947/4885PDE10A 1592/4885HCRTR1 347/4885
US-11326165-B1 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 MBOAT4 3776/4885PDE10A 1347/4885HCRTR1 4453/4885
US-10221162-B2 Triazole agonists of the APJ receptor TBXA2R, AGTR1, AGTR2 MBOAT4 2964/4885PDE10A 1447/4885HCRTR1 770/4885
US-11787810-B2 Diacylglyceride O-acyltransferase 2 inhibitors DGAT2, DGAT1, ACAT2 MBOAT4 113/4885PDE10A 1269/4885HCRTR1 2952/4885
US-20210363147-A1 NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS DGAT2, DGAT1, ACAT2 MBOAT4 110/4885PDE10A 1339/4885HCRTR1 3249/4885
US-20150368269-A1 Factor IXa Inhibitors F9, TFPI, F13B MBOAT4 4299/4885PDE10A 1802/4885HCRTR1 3214/4885
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 MBOAT4 3776/4885PDE10A 1347/4885HCRTR1 4453/4885

“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.