SCHEMBL22300403

SCHEMBL22300403

CCCC1CCC(CCCCC(F)(F)F)C1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.38
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PKM P14618 1/20 0.30
LSS P48449 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
SCHEMBL7794136 0.89 CYP1A2 (0.38) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL7794135 0.89 CYP1A2 (0.38) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL7794133 0.89 CYP1A2 (0.38) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL10568279 0.78 CYP1A2 (0.55) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL10568285 0.78 CYP1A2 (0.55) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL25684438 0.78 CYP1A2 (0.48) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL10570599 0.76 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL10570592 0.76 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTCYP2D6
SCHEMBL28287947 0.76 CYP1A2 (0.38) CYP1A2LMNAMAPK1HTTCYP2C9
SCHEMBL26242235 0.75 CYP1A2 (0.38) CYP1A2LMNAMAPK1HTT

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-11053260-B2 Tri-cycle compound and applications thereof FUJIAN COSUNTER PHARMACEUTICAL CO., LTD. (CN) 2021-07-06 US disclosed
US-20200247819-A1 TRI-CYCLE COMPOUND AND APPLICATIONS THEREOF FUJIAN AKEYLINK BIOTECHNOLOGY CO., LTD. (CN) 2020-08-06 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-20200247819-A1 TRI-CYCLE COMPOUND AND APPLICATIONS THEREOF SLC10A1, NR1H4, HAVCR2 CYP1A2 580/4885LMNA 506/4885MAPK1 1512/4885
US-11053260-B2 Tri-cycle compound and applications thereof SLC10A1, NR1H4, HAVCR2 CYP1A2 580/4885LMNA 506/4885MAPK1 1512/4885

“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.