SCHEMBL5007948

SCHEMBL5007948

Cc1cc(C(=O)O)cc(C(C)(C)C#N)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.53
HCAR1 Q9BXC0 1/20 0.47
RXRA P19793 3/20 0.44
RXRB P28702 3/20 0.44
HCAR2 Q8TDS4 1/20 0.38
CNR2 P34972 1/20 0.36
MRGPRX4 Q96LA9 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BRAF P15056 6/20 0.35
CYP2C9 P11712 3/20 0.35
RXRG P48443 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SRD5A2 P31213 1/20 0.33

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
SCHEMBL3638866 0.89 RXRA (0.42) TPMTHCAR1RXRARXRBALDH1A1
SCHEMBL4388169 0.84 RXRB (0.50) TPMTRXRARXRBSMN1; SMN2RXRG
SCHEMBL5005131 0.83 CA12 (0.50) TPMTHCAR1RXRARXRBALDH1A1
SCHEMBL936865 0.82 CNR2 (0.43) CNR2ALDH1A1BRAFCYP2C9TDP1
SCHEMBL12398885 0.81 NOTUM (0.41) TPMTRXRARXRBHCAR2SMN1; SMN2
SCHEMBL3934869 0.81 HCAR1 (0.46) TPMTHCAR1RXRARXRBHCAR2
SCHEMBL30055155 0.81 TPMT (0.52) TPMTHCAR1RXRARXRBHCAR2
SCHEMBL30056963 0.81 CES2 (0.48) RXRARXRBMRGPRX4ALDH1A1RXRG
SCHEMBL21609834 0.81 CES2 (0.48) RXRARXRBMRGPRX4ALDH1A1RXRG
SCHEMBL29448808 0.81 HCAR1 (0.46) TPMTHCAR1RXRARXRBHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149414-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-18 US disclosed
US-20230149414-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-18 US disclosed
CN-115484948-A Compound and use thereof 福宏治疗公司 2022-12-16 CN disclosed
EP-4096657-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 EP disclosed
WO-2021155316-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed
WO-2021155316-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed
US-20080207616-A1 Quinoxalines as B Baf Inhhibitors ASTRAZENECA AB (SE) 2008-08-28 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 (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-20230149414-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB TPMT 463/4885HCAR1 4259/4885RXRA 163/4885
US-20080207616-A1 Quinoxalines as B Baf Inhhibitors BRAF, NRAS, ARAF TPMT 3329/4885HCAR1 3661/4885RXRA 1890/4885

“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.