SCHEMBL3015736

SCHEMBL3015736

COC(Cc1sc(Cl)cc1C1(O)CCN(Cc2ccccc2)CC1)OC

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 2/20 0.49
▸ CCR3 P51677 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CCR8 P51685 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
SCHEMBL8107817 0.88 OPRL1 (0.47) OPRL1CCR3POLBCCR8
SCHEMBL3026822 0.88 OPRL1 (0.47) OPRL1CCR3POLBCCR8
SCHEMBL3018645 0.83 OPRL1 (0.49) OPRL1CCR3POLB
SCHEMBL3006710 0.74 OPRL1 (0.47) OPRL1CCR3POLBCCR8
SCHEMBL3007375 0.73 KCNH2 (0.52) OPRL1CCR3POLB
SCHEMBL25355733 0.72 OPRL1 (0.57) OPRL1CCR3POLBCCR8
SCHEMBL3008509 0.72 SIGMAR1 (0.44) CCR3
SCHEMBL1266245 0.71 CCR3 (0.59) OPRL1CCR3POLBCCR8
SCHEMBL2970071 0.70 CHRM4 (0.64) OPRL1CCR3POLBCCR8
SCHEMBL31028218 0.70 CHRM4 (0.64) OPRL1CCR3POLBCCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170903-B1 SPIRO[PIPERIDINE-4,4' -THIENO[3, 2-C]PYRAN]DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS ESTEVE LABOR DR (ES) 2012-09-05 — — EP disclosed
US-20100190813-A1 SPIRO [PIPERIDINE-4- 4' -THIENO [3,2-C] PYRAN] DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS OBERDORF CHRISTOPH 2010-07-29 — — US disclosed
US-20100190813-A1 SPIRO [PIPERIDINE-4- 4' -THIENO [3,2-C] PYRAN] DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS OBERDORF CHRISTOPH 2010-07-29 — — US disclosed
US-20100190813-A1 SPIRO [PIPERIDINE-4- 4' -THIENO [3,2-C] PYRAN] DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS OBERDORF CHRISTOPH 2010-07-29 — — US disclosed
WO-2008155132-A1 SPIRO [PIPERIDINE-4, 4' -THIENO [3, 2-C] PYRAN] DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2008-12-24 — — 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-20100190813-A1 SPIRO [PIPERIDINE-4- 4' -THIENO [3,2-C] PYRAN] DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE SIGMA RECEPTOR FOR THE TREATMENT OF PSYCHOSIS SIGMAR1, OPRD1, OPRK1 OPRL1 6/4885CCR3 2073/4885POLB 1748/4885

“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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