SCHEMBL18367585

SCHEMBL18367585

CC(C)(C)c1cn(-c2ccccc2C(F)(F)F)nn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 2/20 0.49
▸ GABRA2 P47869 1/20 0.48
▸ GABRB2 P47870 1/20 0.48
▸ APP P05067 1/20 0.43
▸ AR P10275 3/20 0.43
▸ AMY1A P0DUB6 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HSD11B1 P28845 2/20 0.39

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
SCHEMBL21849198 0.88 TRPV1 (0.43) TRPV1GABRA2GABRB2APPAR
SCHEMBL21849514 0.82 TRPV1 (0.43) TRPV1GABRA2GABRB2APPAR
SCHEMBL13145592 0.81 NOTUM (0.54) TRPV1GABRA2GABRB2HSD11B1CA12
SCHEMBL18377889 0.81 NOTUM (0.52) TRPV1APPAMY1AALDH1A1KMT2A
SCHEMBL28329509 0.78 NOTUM (0.41) TRPV1GABRA2GABRB2ARCA1
SCHEMBL22702132 0.77 TRPV1 (0.48) TRPV1APPAMY1AALDH1A1KMT2A
SCHEMBL19732301 0.77 TRPV1 (0.61) TRPV1APPAMY1AALDH1A1RXRA
SCHEMBL28875210 0.75 BCHE (0.60) TRPV1APPAMY1ALMNACA12
SCHEMBL26031187 0.74 FLT3 (0.53) TRPV1GABRA2GABRB2ARALDH1A1
SCHEMBL6932500 0.73 P2RX7 (0.50) GABRA2GABRB2ARHSD11B1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-12-21 — — US disclosed
US-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 — — US disclosed
US-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 — — US disclosed
US-20170008873-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-01-12 — — 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 TRPV1 4828/4885GABRA2 2029/4885GABRB2 840/4885
US-20170008873-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS TRPV1 4828/4885GABRA2 2029/4885GABRB2 840/4885

“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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