SCHEMBL31691660

SCHEMBL31691660

CC(O)c1c(Cl)cc2c(cnn2C2CCCCO2)c1Br

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.40
▸ CYP4A11 Q02928 2/20 0.40
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ RET P07949 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ DGAT2 Q96PD7 1/20 0.35
▸ IDH1 O75874 1/20 0.34
▸ ATR Q13535 4/20 0.34
▸ PDE9A O76083 1/20 0.33
▸ SLC6A3 Q01959 4/20 0.32
▸ KDM5B Q9UGL1 1/20 0.32
▸ YTHDC1 Q96MU7 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
SCHEMBL30959175 0.91 RXRA (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31691677 0.89 CYP4F2 (0.44) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31642644 0.88 RXRA (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL30959357 0.86 RXRA (0.39) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31527099 0.84 RXRA (0.42) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL29937567 0.84 CYP4F2 (0.40) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21196016 0.84 CYP4F2 (0.40) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21196028 0.83 RXRA (0.41) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL29804208 0.83 RXRA (0.41) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31127858 0.82 RXRA (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304599-A1 MACROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2025-10-02 — — 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 (1 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-20250304599-A1 MACROCYCLIC COMPOUNDS AND METHODS OF USE KRAS, NRAS, HRAS CYP4F2 4059/4885CYP4A11 1348/4885RXRA 1531/4885

“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.

Send feedback