SCHEMBL29458277

SCHEMBL29458277

OC1(F)c2ccccc2CC1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.35
MAPK1 P28482 2/20 0.35
MEN1 O00255 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
BCHE P06276 1/20 0.35
CHRM5 P08912 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
NFKB1 P19838 1/20 0.35
PRCP P42785 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35

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
SCHEMBL15528148 1.00 CYP3A4 (0.35) CYP3A4MAPK1MEN1CYP2D6ALOX15
SCHEMBL18048399 0.79 CYP3A4 (0.37) CYP3A4MAPK1MEN1CYP2D6ALOX15
SCHEMBL28302686 0.78 CYP3A4 (0.41) CYP3A4MAPK1MEN1CYP2D6ALOX15
SCHEMBL27763868 0.76 LMNA (0.38)
SCHEMBL28145473 0.73 CYP3A4 (0.43) CYP3A4MAPK1MEN1CYP2D6ALOX15
SCHEMBL28266761 0.70 KMT2A (0.33) KMT2A
SCHEMBL30792983 0.69 CYP3A4 (0.33) CYP3A4MAPK1MEN1CYP2D6ALOX15
SCHEMBL21801631 0.68 MAPK1 (0.53) MAPK1SMN1; SMN2
SCHEMBL27937705 0.68 MAOA (0.36) CYP2D6CYP2C19TSHRNFKB1SMN1; SMN2
SCHEMBL30726174 0.67 PDK2 (0.34) MAPK1SMN1; SMN2

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-20220081407-A1 METHODS OF PREPARING SUBSTITUTED INDANES PELOTON THERAPEUTICS, INC. (US) 2022-03-17 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-20220081407-A1 METHODS OF PREPARING SUBSTITUTED INDANES HIF1AN, EGLN2, HIF1A CYP3A4 609/4885MAPK1 3060/4885MEN1 2565/4885

“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.