SCHEMBL6482674

SCHEMBL6482674

Oc1ccc(C2CCC(N(CCCc3ccccc3)Cc3ccccc3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
OPRM1 P35372 4/20 0.44
OPRD1 P41143 4/20 0.44
OPRK1 P41145 4/20 0.44
MEN1 O00255 2/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SPHK1 Q9NYA1 1/20 0.41
ACKR3 P25106 1/20 0.41

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
SCHEMBL5689734 0.90 OPRM1 (0.44) OPRM1OPRD1OPRK1SPHK1
SCHEMBL5690258 0.89 GRIN2B (0.53) OPRM1OPRD1OPRK1SPHK1
SCHEMBL5690254 0.89 GRIN2B (0.53) OPRM1OPRD1OPRK1SPHK1
SCHEMBL7072271 0.84 GRIN2B (0.50) OPRM1OPRD1OPRK1SPHK1
SCHEMBL7072272 0.84 GRIN2B (0.50) OPRM1OPRD1OPRK1SPHK1
SCHEMBL5689666 0.83 KDM4E (0.52) SPHK1
SCHEMBL7023319 0.83 KDM4E (0.52) SPHK1
SCHEMBL5689661 0.83 KDM4E (0.52) SPHK1
SCHEMBL6485638 0.81 SPHK1 (0.43) OPRM1OPRD1OPRK1SPHK1
SCHEMBL6486349 0.81 SPHK1 (0.43) OPRM1OPRD1OPRK1SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030236286-A1 Cyclohexylamine derivative as subtype selective nmda receptor antagonists DEORAZIO RUSSELL JOSEPH (US) 2003-12-25 US claimed
CN-1441773-A Cyclohexylamine derivative as subtype selective NMDA receptor Antagonists WARNER LAMBERT CO (US) 2003-09-10 CN claimed
EP-1278716-A1 CYCLOHEXYLAMINE DERIVATIVE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2003-01-29 EP claimed
WO-2001081295-A1 CYCLOHEXYLAMINE DERIVATIVE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2001-11-01 WO claimed
US-6919377-B2 Cyclohexylamine derivative as subtype selective NMDA receptor antagonists WARNER LAMBERT COMPANY LLC (US) 2005-07-19 US disclosed
US-20030236286-A1 Cyclohexylamine derivative as subtype selective nmda receptor antagonists DEORAZIO RUSSELL JOSEPH (US) 2003-12-25 US disclosed
CN-1441773-A Cyclohexylamine derivative as subtype selective NMDA receptor Antagonists WARNER LAMBERT CO (US) 2003-09-10 CN disclosed
EP-1278716-A1 CYCLOHEXYLAMINE DERIVATIVE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2003-01-29 EP disclosed
WO-2001081295-A1 CYCLOHEXYLAMINE DERIVATIVE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2001-11-01 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 (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-20030236286-A1 Cyclohexylamine derivative as subtype selective nmda receptor antagonists GRIN1, GRIN2A, GRIN2B KMT2A 1532/4885OPRM1 18/4885OPRD1 42/4885

“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.