SCHEMBL19732322

SCHEMBL19732322

Cc1c(-c2cncc(-c3cc(-c4ccncc4)c(C)c(C(C)(C)C)c3)c2)cccc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.38
KIF11 P52732 2/20 0.36
MAPK10 P53779 1/20 0.32
LRRK2 Q5S007 1/20 0.32
NTRK1 P04629 1/20 0.31
TRPA1 O75762 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
SCHEMBL19726599 0.83 KIF11 (0.44) KIF11LRRK2
SCHEMBL22702214 0.74 EPHX1 (0.38) FYNMAPK10LRRK2
SCHEMBL22797016 0.74 FYN (0.38) FYNMAPK10LRRK2TRPA1
SCHEMBL19726603 0.73 KIF11 (0.49) KIF11
SCHEMBL22702052 0.72 FYN (0.39) FYNMAPK10LRRK2
SCHEMBL19726596 0.70 CA2 (0.38) KIF11TRPA1
SCHEMBL8679577 0.69 PDCD1 (0.50) KIF11TRPA1
SCHEMBL9261823 0.69 KIF11 (0.47) KIF11MAPK10TRPA1
SCHEMBL19726594 0.64 AKT1 (0.43) LRRK2TRPA1
SCHEMBL12068479 0.64 MAPT (0.61) KIF11

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-10316017-B2 COT modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2019-06-11 US disclosed
US-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-12-21 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-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS FYN 2171/4885KIF11 3487/4885MAPK10 3198/4885
US-10316017-B2 COT modulators and methods of use thereof BRDT, THRB, HCCS FYN 2171/4885KIF11 3487/4885MAPK10 3198/4885

“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.