SCHEMBL11919920

SCHEMBL11919920

COc1ccc(-n2c(SCC(=O)Nc3ccccc3Br)nnc2-c2ccncc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ TP53 P04637 1/20 0.62
▸ MAPT P10636 4/20 0.61
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ POLB P06746 3/20 0.57
▸ PTK2 Q05397 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.56
▸ PKM P14618 1/20 0.56
▸ HTT P42858 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.55
▸ NR2E3 Q9Y5X4 1/20 0.55

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
SCHEMBL15606898 0.85 TP53 (0.83) MEN1KMT2ATP53MAPTCYP3A4
SCHEMBL16486900 0.83 SMN1; SMN2 (0.74) MEN1KMT2ATP53MAPTCYP3A4
SCHEMBL16486439 0.81 POLB (0.80) MEN1KMT2ATP53MAPTRECQL
SCHEMBL16486486 0.79 TP53 (0.72) MEN1KMT2ATP53MAPTCYP3A4
SCHEMBL6192012 0.79 ALPG (0.69) MAPTCYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL16486353 0.79 TACR1 (0.61) MEN1KMT2ATP53MAPTSMN1; SMN2
SCHEMBL6193193 0.78 CDC25A (0.74) MEN1KMT2AMAPTRECQLPOLB
SCHEMBL13047160 0.78 TP53 (0.63) TP53MAPTCYP3A4CYP2D6CYP2C9
SCHEMBL30269932 0.77 MAPT (0.67) TP53MAPTCYP3A4CYP2D6CYP2C9
SCHEMBL13856361 0.77 PTK2 (0.79) MEN1KMT2ATP53MAPTCYP3A4

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-8883827-B2 Azole derivatives as WTN pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2014-11-11 — — US disclosed
US-8883827-B2 Azole derivatives as WTN pathway inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2014-11-11 — — US disclosed
US-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2012-08-16 — — US disclosed
US-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors OSLO UNIVERSITY HOSPITAL HF (NO) 2012-08-16 — — 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-20120208828-A1 Azole Derivatives as WTN Pathway Inhibitors WNT1, AXIN2, WNT3 MEN1 793/4885KMT2A 4257/4885TP53 53/4885

“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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