SCHEMBL21243871

SCHEMBL21243871

Cc1c(Cl)cc2c(cnn2C2CCCCO2)c1[C@@H]1CC(O)=C(C(=O)O)C[C@H]1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
DGAT2 Q96PD7 1/20 0.32
ATR Q13535 1/20 0.31

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
SCHEMBL21259535 0.91 CYP4F2 (0.34) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21243908 0.89 RXRA (0.39) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21243948 0.81 RXRA (0.39) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21243873 0.81 CYP4F2 (0.34) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30950258 0.77 CYP4F2 (0.45) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21196144 0.77 CYP4F2 (0.45) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21259534 0.77 CYP4F2 (0.35) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21196016 0.72 CYP4F2 (0.40) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL31299320 0.72 CYP4F2 (0.42) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL29937567 0.72 CYP4F2 (0.40) RXRARXRBRXRGCYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3749665-A1 TETRAHYDROQUINAZOLINE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Inc. (US) 2020-12-16 EP disclosed
US-10590115-B2 Tetrahydroquinazoline derivatives useful as anticancer agents PFIZER INC. (US) 2020-03-17 US disclosed
US-20190248767-A1 Tetrahydroquinazoline Derivatives Useful as Anticancer Agents PFIZER INC. (US) 2019-08-15 US disclosed
WO-2019155399-A1 TETRAHYDROQUINAZOLINE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-08-15 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-20190248767-A1 Tetrahydroquinazoline Derivatives Useful as Anticancer Agents TOP2A, TOP1, TOP2B RXRA 4159/4885RXRB 4354/4885RXRG 3929/4885
US-10590115-B2 Tetrahydroquinazoline derivatives useful as anticancer agents TOP2A, TOP1, TOP2B RXRA 4159/4885RXRB 4354/4885RXRG 3929/4885

“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.