SCHEMBL26836559

SCHEMBL26836559

CCCCCCC(C)(CC)c1ccc(C)cn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 13/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CNR1 P21554 11/20 0.35
▸ MCHR1 Q99705 1/20 0.34
▸ CCR1 P32246 1/20 0.33
▸ CCR5 P51681 1/20 0.33
▸ CCR8 P51685 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ NOS3 P29474 1/20 0.32
▸ NOS2 P35228 1/20 0.32

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
SCHEMBL22487886 0.94 CNR2 (0.39) CNR2ALDH1A1KDM4EGAAMAPT
SCHEMBL22375335 0.92 CNR2 (0.38) CNR2ALDH1A1KDM4EGAAMAPT
SCHEMBL25946278 0.87 CCR1 (0.38) ALDH1A1KDM4EGAAMAPTHPGD
SCHEMBL17828092 0.83 CCR1 (0.43) ALDH1A1KDM4EGAAMAPTHPGD
SCHEMBL20047718 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL20031198 0.81 HPGD (0.35) CNR2ALDH1A1KDM4EGAAHPGD
SCHEMBL19464607 0.80 KDM4E (0.47) CNR2ALDH1A1KDM4EHPGDCNR1
SCHEMBL19425843 0.79 CNR2 (0.36) CNR2CNR1HTT
SCHEMBL25086407 0.78 CNR2 (0.39) CNR2CNR1
SCHEMBL21719130 0.78 KDM4E (0.31) KDM4EMAPTHPGDHTT

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-20230381144-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN SYNVENTA LLC (US) 2023-11-30 — — 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-20230381144-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN TRPV1, OPRL1, ADRA2C CNR2 11/4885ALDH1A1 1427/4885KDM4E 4754/4885

“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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