SCHEMBL18375348

SCHEMBL18375348

Cc1c(-c2ccncc2)cccc1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.39
PIK3CD O00329 1/20 0.39
GABRA1 P14867 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
LMNA P02545 2/20 0.38
FAAH O00519 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
GABRB1 P18505 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2C P28335 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL22797016 0.83 FYN (0.38) LRRK2TEKGCGRMAPK10NFATC1
SCHEMBL6318808 0.82 PDCD1 (0.50) GABRA1GABRG2GABRB3CA1CA2
SCHEMBL8819417 0.82 CA12 (0.51) GABRA1CA1CA2LMNATSHR
SCHEMBL18367725 0.81 GABRA1 (0.38) GABRA1GABRG2GABRB3CA1CA2
SCHEMBL18367721 0.81 CYP2A6 (0.46) LMNACYP1A2CYP3A4HPGDPARP10
SCHEMBL23674396 0.80 MAPT (0.41) PIK3CDGABRA1GABRG2GABRB3CA1
SCHEMBL14493338 0.78 RPS6KA3 (0.41) LRRK2LMNACYP1A2CYP3A4HPGD
SCHEMBL12648686 0.78 CA1 (0.40) LRRK2GABRA1GABRG2GABRB3CA1
SCHEMBL13365627 0.77 KIF11 (0.41) CA1CA2CA12CA9MAPT
SCHEMBL2883390 0.77 PIK3CD (0.41) LRRK2PIK3CDLMNACYP1A2PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11325930-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2022-05-10 US disclosed
US-20210147454-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2021-05-20 US disclosed
US-10947259-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2021-03-16 US disclosed
US-20210061831-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2021-03-04 US disclosed
WO-2020252151-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. (US) 2020-12-17 WO disclosed
US-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 US disclosed
WO-2017007694-A1 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS GILEAD SCIENCES, INC. (US) 2017-01-12 WO 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 (4 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-11325930-B2 Cot modulators and methods of use thereof BRDT, THRB, HCCS LRRK2 4599/4885PIK3CD 1172/4885GABRA1 1992/4885
US-10947259-B2 Cot modulators and methods of use thereof BRDT, THRB, HCCS LRRK2 4599/4885PIK3CD 1172/4885GABRA1 1992/4885
US-20210147454-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS LRRK2 4599/4885PIK3CD 1172/4885GABRA1 1992/4885
US-20210061831-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS LRRK2 4599/4885PIK3CD 1172/4885GABRA1 1992/4885

“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.