SCHEMBL13064436

SCHEMBL13064436

CCc1nc(C(F)(F)F)ccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 1/20 0.38
▸ GRM2 Q14416 1/20 0.36
▸ GABRB3 P28472 3/20 0.36
▸ GABRA2 P47869 2/20 0.36
▸ GABRB2 P47870 2/20 0.36
▸ LMNA P02545 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PTGS2 P35354 3/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ NT5E P21589 1/20 0.34
▸ HEXA P06865 1/20 0.34
▸ HEXB P07686 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL15820211 0.81 TRPV3 (0.40) TRPV3GABRB3NT5EPDE2APDE10A
SCHEMBL1758556 0.80 TRPV3 (0.36) TRPV3PTGS2PTGS1NT5E
Hydrochloric Acid SCHEMBL6443124 0.79 LOXL2 (0.40) TRPV3GRM2KDM4ENT5EPDE2A
SCHEMBL21419162 0.78 HEXA (0.35) TRPV3KDM4EPTGS2HEXAHEXB
SCHEMBL20303516 0.78 TRPV3 (0.39) TRPV3NT5EPDE2APDE10A
SCHEMBL4488040 0.78 CNR1 (0.36) KDM4EHEXAHEXBL3MBTL1CNR1
SCHEMBL25271011 0.77 HEXA (0.34) TRPV3KDM4EPTGS2PTGS1NT5E
SCHEMBL16068142 0.77 HEXA (0.41) GABRB3GABRA2GABRB2LMNAKDM4E
SCHEMBL30408730 0.77 HEXA (0.34) TRPV3KDM4EPTGS2PTGS1NT5E
SCHEMBL24136995 0.77 HEXA (0.34) TRPV3LMNAKDM4EPTGS2HEXA

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-20100331348-A1 TROPANE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-12-30 — — 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-20100331348-A1 TROPANE DERIVATIVES USEFUL AS PESTICIDES DDT, ACHE, TPM3 TRPV3 305/4885GRM2 628/4885GABRB3 576/4885

“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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