SCHEMBL9019738

SCHEMBL9019738

O=C(O)CC1CCCc2c1n(Cc1ccc(-n3ccnc3)cc1)c1ccc(Cl)cc21

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 19/20 0.65
PTGDR Q13258 15/20 0.61
PDE2A O00408 3/20 0.51
TBXAS1 P24557 1/20 0.50

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
SCHEMBL9019680 0.91 TBXA2R (0.72) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019681 0.91 TBXA2R (0.57) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019718 0.89 TBXA2R (0.69) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019715 0.87 TBXA2R (0.56) TBXA2RPTGDRPDE2A
SCHEMBL9518358 0.86 TBXA2R (0.85) TBXA2RPTGDRPDE2A
SCHEMBL9019741 0.83 TBXA2R (0.61) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019689 0.82 TBXA2R (0.71) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019684 0.82 TBXA2R (0.72) TBXA2RPTGDRPDE2A
SCHEMBL9019688 0.80 TBXA2R (0.74) TBXA2RPTGDRPDE2ATBXAS1
SCHEMBL9019685 0.80 TBXA2R (0.57) TBXA2RPTGDRPDE2ATBXAS1

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-0496237-B1 N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole PHARMACIA SPA (IT) 1996-02-14 EP claimed
EP-0496237-A2 N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole PHARMACIA S.p.A. (IT) 1992-07-29 EP claimed
EP-0496237-B1 N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole PHARMACIA SPA (IT) 1996-02-14 EP disclosed
US-5238953-A Thromboxane a2 antagonist FARMITALIA CARLO ERBA S.R.L. (IT) 1993-08-24 US disclosed
EP-0496237-A2 N-imidazolyl derivatives of substituted tetrahydrocarbazole and cyclohept[b]indole PHARMACIA S.p.A. (IT) 1992-07-29 EP disclosed