SCHEMBL7239736

SCHEMBL7239736

CCC(N)N1CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.64
▸ OPRM1 P35372 16/20 0.50
▸ GRIN2D O15399 1/20 0.50
▸ GRIN3B O60391 1/20 0.50
▸ CHRM2 P08172 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ GRIN1 Q05586 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ GRIN2A Q12879 1/20 0.50
▸ GRIN2B Q13224 1/20 0.50
▸ GRIN2C Q14957 1/20 0.50
▸ GRIN3A Q8TCU5 1/20 0.50
▸ OPRD1 P41143 12/20 0.48
▸ OPRK1 P41145 12/20 0.48
▸ OPRL1 P41146 12/20 0.48
▸ DRD4 P21917 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ KMT2A Q03164 1/20 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
SCHEMBL7246679 0.82 OPRM1 (0.54) CYP2D6OPRM1OPRD1OPRL1KMT2A
SCHEMBL11739541 0.80 OPRM1 (0.73) CYP2D6OPRM1GRIN2DGRIN3BCHRM2
Hydrochloric Acid SCHEMBL11745286 0.79 OPRM1 (0.71) CYP2D6OPRM1GRIN2DGRIN3BCHRM2
Prodipine SCHEMBL148420 0.78 CYP2D6 (1.00) CYP2D6OPRM1GRIN2DGRIN3BCHRM2
SCHEMBL7245088 0.77 OPRM1 (0.52) OPRM1CHRM1KCNH2OPRD1OPRK1
Prodipine SCHEMBL11739494 0.77 CYP2D6 (0.96) CYP2D6OPRM1GRIN2DGRIN3BCHRM2
SCHEMBL7238669 0.76 OPRM1 (0.68) OPRM1KCNH2OPRD1OPRK1MEN1
SCHEMBL11742871 0.74 OPRM1 (0.56) CYP2D6OPRM1GRIN2DGRIN3BCHRM2
SCHEMBL4249531 0.74 OPRM1 (0.59) CYP2D6OPRM1CHRM2CHRM1KCNH2
SCHEMBL11739533 0.73 CYP2D6 (0.65) CYP2D6OPRM1GRIN2DGRIN3BCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6608086-B2 Selective adrenergic receptor alpha 1C antagonists without significant calcium channel activity; treating benign prostatic hyperplasia, intraocular pressure and inhibiting cholesterol synthesis SYNAPTIC PHARMACEUTICAL CORPORATION 2003-08-19 — — US disclosed
US-20020193599-A1 Dihydropyridines and new uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-12-19 — — US disclosed
US-20020010186-A1 Dihydropyrimidines and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-01-24 — — US disclosed
US-6310076-B1 TREATING BENIGN PROSTATIC HYPERPLASIA, LOWERING INTRAOCULAR PRESSURE, INHIBITING CHOLESTEROL SYNTHESIS, TREATING DISEASES MEDIATED BY ALPHA-1 RECEPTORS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-10-30 — — US disclosed
US-6268369-B1 ALPHA SUB 1 INHIBITORS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-07-31 — — US disclosed
US-6211198-B1 BENIGN PROSTATE HYPERPLASIA; INTRAOCULAR PRESSURE; HYPOTENSIVE AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-04-03 — — US disclosed
US-5767131-A TREATMENT OF BENIGN PROSTATIC HYPERPLASIA, INHIBITION OF CHOLESTEROL SYNTHESIS, LOWERING OF INTRAOCULAR PRESSURE; ALPHA-ADRENERGIC RECEPTOR DISEASES SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-06-16 — — US disclosed
WO-1994022829-A2 DIHYDROPYRIDINES AND NEW USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1994-10-13 — — 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 (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-20020010186-A1 Dihydropyrimidines and uses thereof QDPR, DPYD, ADRA1D CYP2D6 87/4885OPRM1 878/4885GRIN2D 2902/4885
US-20020193599-A1 Dihydropyridines and new uses thereof BPHL, BCKDK, DHCR7 CYP2D6 601/4885OPRM1 311/4885GRIN2D 3212/4885

“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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