SCHEMBL3603128

SCHEMBL3603128

COC(=O)c1ccc(N2CCN(c3nnc(Cc4ccccc4)c4ccccc34)C(C)C2)nc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SGPL1 O95470 7/20 0.76
SMO Q99835 11/20 0.68

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
SCHEMBL3603119 1.00 SGPL1 (0.76) SGPL1SMO
SCHEMBL20431356 0.89 SGPL1 (0.63) SGPL1SMO
SCHEMBL20431354 0.88 SMO (0.79) SGPL1SMO
SCHEMBL3600788 0.86 SGPL1 (1.00) SGPL1SMO
SCHEMBL3600783 0.86 SGPL1 (1.00) SGPL1SMO
SCHEMBL13445145 0.85 SMO (0.79) SGPL1SMO
SCHEMBL3611158 0.84 SMO (0.71) SGPL1SMO
SCHEMBL20431242 0.84 SMO (0.71) SGPL1SMO
SCHEMBL14084447 0.83 SMO (0.75) SGPL1SMO
SCHEMBL14084446 0.83 SMO (0.75) SGPL1SMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536168-B2 Benzyl and pyridinyl derivatives as modulators of the hedgehog signaling pathway NOVARTIS AG (CH) 2013-09-17 US disclosed
CN-101657430-B Organic compounds and uses thereof NOVARTIS AG CH 2013-05-01 CN disclosed
US-20100069368-A1 Organic Compounds and Their Uses NOVARTIS AG (CH) 2010-03-18 US disclosed
CN-101657430-A Organic compounds and uses thereof NOVARTIS AG CH 2010-02-24 CN 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-20100069368-A1 Organic Compounds and Their Uses SHH, GLI1, VHL SGPL1 3140/4885SMO 5/4885

“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.