SCHEMBL1097303

SCHEMBL1097303

CC(C)(C)[SiH2]OC(C)(C)c1cncn1Cc1ccccc1C#N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.42
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 2/20 0.39
GALR3 O60755 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 2/20 0.35
NPBWR1 P48145 1/20 0.34
BRD4 O60885 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
KMT2A Q03164 1/20 0.34
CREBBP Q92793 1/20 0.34
BACE1 P56817 1/20 0.34
TP53 P04637 2/20 0.33
CFTR P13569 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL3463866 0.78 CYP11B2 (0.38) CYP19A1CYP11B1CYP11B2
SCHEMBL27735977 0.77 CYP19A1 (0.38) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL1097393 0.74 FNTA (0.31)
SCHEMBL1097299 0.70 CYP19A1 (0.42) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
Hydrochloric Acid SCHEMBL7847528 0.70 CYP19A1 (0.52) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL1097298 0.69 CYP19A1 (0.41) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL1096475 0.69 CYP19A1 (0.41) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL1950222 0.69 CYP11B1 (0.63) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL12820668 0.69 CYP11B1 (0.58) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3
SCHEMBL8441652 0.67 CYP19A1 (0.49) CYP19A1ALDH1A1SMN1; SMN2MAPTGALR3

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-8153674-B2 Organic compounds NOVARTIS AG (CH) 2012-04-10 US disclosed
US-20090182007-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US disclosed
EP-2001866-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-12-17 EP disclosed
WO-2007117982-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-18 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-20090182007-A1 ORGANIC COMPOUNDS REN, CYP17A1, HSD17B1 CYP19A1 166/4885ALDH1A1 215/4885SMN1; SMN2 4735/4885

“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.