SCHEMBL26060359

SCHEMBL26060359

CCc1cc(O)cc2ccc(F)c(C)c12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 12/20 0.49
▸ ESR2 Q92731 12/20 0.49
▸ BACE1 P56817 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PTPN11 Q06124 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
SCHEMBL25040924 0.85 ESR1 (0.50) ESR1ESR2BACE1KDM4ELMNA
SCHEMBL24755557 0.83 ESR1 (0.49) ESR1ESR2BACE1KDM4ELMNA
SCHEMBL27062915 0.83 ESR1 (0.41) ESR1ESR2BACE1KDM4EMAPK1
SCHEMBL27338820 0.83 CYP1A2 (0.37) ESR1ESR2BACE1
SCHEMBL25079756 0.82 ESR1 (0.48) ESR1ESR2BACE1KDM4ELMNA
SCHEMBL24680259 0.82 ESR1 (0.48) ESR1ESR2BACE1MAPT
SCHEMBL26502462 0.80 ESR1 (0.49) ESR1ESR2BACE1KDM4ELMNA
SCHEMBL24175927 0.79 ESR1 (0.39) ESR1ESR2ALOX15
SCHEMBL25040639 0.78 ESR1 (0.45) ESR1ESR2BACE1
SCHEMBL25808804 0.78 ESR1 (0.45) ESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 — — US disclosed
US-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-08-03 — — 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-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS ESR1 806/4885ESR2 1552/4885BACE1 3546/4885
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS ESR1 764/4885ESR2 887/4885BACE1 2530/4885

“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.

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