SCHEMBL13508302

SCHEMBL13508302

Cc1ccc(Cn2c(CO)nc3ccccc32)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.72
▸ MEN1 O00255 3/20 0.72
▸ KMT2A Q03164 3/20 0.72
▸ LMNA P02545 3/20 0.72
▸ TP53 P04637 2/20 0.72
▸ HTT P42858 2/20 0.72
▸ MAPT P10636 2/20 0.72
▸ TNF P01375 1/20 0.67
▸ TSHR P16473 1/20 0.67
▸ RAB9A P51151 2/20 0.61
▸ POLB P06746 1/20 0.58
▸ AGTR1 P30556 1/20 0.57
▸ AGTR2 P50052 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL6834800 0.89 TP53 (0.69) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL15568834 0.88 POLB (0.74) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL8366932 0.87 RAB9A (0.76) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL13186949 0.87 HIF1A (0.67) MEN1KMT2ALMNAMAPTTNF
SCHEMBL12771528 0.85 LMNA (0.69) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL6833621 0.81 TNF (0.81) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL10089254 0.81 VDR (0.61) SMN1; SMN2MEN1KMT2ALMNATP53
SCHEMBL16756579 0.81 TSHR (1.00) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL30582653 0.81 TSHR (1.00) SMN1; SMN2MEN1KMT2ATP53MAPT
SCHEMBL13144806 0.81 CYP1A2 (0.80) MEN1KMT2ALMNAMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9101628-B2 Methods and composition of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2015-08-11 — — US disclosed
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-02-04 — — 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-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 SMN1; SMN2 2247/4885MEN1 4880/4885KMT2A 2858/4885

“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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