SCHEMBL21243873

SCHEMBL21243873

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

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
RET P07949 1/20 0.32
IDH1 O75874 1/20 0.32
DGAT2 Q96PD7 1/20 0.31
PDE1A P54750 4/20 0.31
PDE1B Q01064 4/20 0.31
PDE1C Q14123 4/20 0.31
YTHDC1 Q96MU7 1/20 0.31
PDE9A O76083 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
SCHEMBL21259543 0.87 RXRA (0.36) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21243952 0.87 RXRA (0.36) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21259484 0.84 CYP4F2 (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21722188 0.84 CYP4F2 (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21243881 0.84 CYP4F2 (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21243871 0.81 RXRA (0.37) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21259535 0.79 CYP4F2 (0.34) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21243948 0.78 RXRA (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21196144 0.76 CYP4F2 (0.45) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21196016 0.76 CYP4F2 (0.40) CYP4F2CYP4A11RXRARXRBRXRG

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 5 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
WO-2019155399-A1 TETRAHYDROQUINAZOLINE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-08-15 WO disclosed
US-20190248767-A1 Tetrahydroquinazoline Derivatives Useful as Anticancer Agents PFIZER INC. (US) 2019-08-15 US disclosed
US-20190248767-A1 Tetrahydroquinazoline Derivatives Useful as Anticancer Agents PFIZER INC. (US) 2019-08-15 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-20190248767-A1 Tetrahydroquinazoline Derivatives Useful as Anticancer Agents TOP2A, TOP1, TOP2B CYP4F2 579/4885CYP4A11 1687/4885RXRA 4159/4885
US-10590115-B2 Tetrahydroquinazoline derivatives useful as anticancer agents TOP2A, TOP1, TOP2B CYP4F2 579/4885CYP4A11 1687/4885RXRA 4159/4885

“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.