SCHEMBL23488127

SCHEMBL23488127

C[Si](C)(C)c1cn(-c2cc(Cl)c(Cl)c(C(F)(F)F)c2)nn1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 12/20 0.55
AR P10275 2/20 0.45
KCNH2 Q12809 3/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
GPR119 Q8TDV5 1/20 0.36
RXRA P19793 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35

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
SCHEMBL6867861 0.72 GABRA2 (0.65) NOTUM
SCHEMBL21776985 0.71 NOTUM (1.00) NOTUM
SCHEMBL22584705 0.70 AR (0.68) NOTUMARKCNH2CA12CA1
SCHEMBL23488361 0.69 NOTUM (1.00) NOTUM
SCHEMBL29479281 0.67 NOTUM (0.53) NOTUMKCNH2CA12CA1CA2
SCHEMBL24958858 0.67 NOTUM (0.52) NOTUMCA12CA1CA2CA9
SCHEMBL31636683 0.66 NOTUM (0.57) NOTUMCA12CA1CA2CA9
SCHEMBL28904479 0.64 CA12 (0.51) NOTUMKCNH2CA12CA1CA2
SCHEMBL2886167 0.63 P2RX7 (0.52) NOTUMCA12CA1CA2CA9
SCHEMBL25946907 0.62 KAT7 (0.41) NOTUMARRXRAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 US 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-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT NOTUM 5/4885AR 3945/4885KCNH2 4604/4885

“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.