SCHEMBL22601573

SCHEMBL22601573

CC(C)(C)c1cc(C(=O)Nc2ccncc2)ccn1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.79
SMN1; SMN2 Q16637 2/20 0.79
NPC1 O15118 2/20 0.79
RAB9A P51151 2/20 0.79
ALDH1A1 P00352 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 2/20 0.56
GAA P10253 1/20 0.56
NT5E P21589 1/20 0.55
HTT P42858 2/20 0.54
PRKCI P41743 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPK1 P28482 1/20 0.53
PKM P14618 1/20 0.52
JAK2 O60674 1/20 0.51
TYK2 P29597 1/20 0.51

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
SCHEMBL22601457 0.88 LMNA (1.00) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601460 0.87 LMNA (0.82) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601584 0.86 LMNA (0.80) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601544 0.83 LMNA (0.85) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601588 0.83 LMNA (0.76) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601575 0.80 LMNA (0.74) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601558 0.80 LMNA (0.74) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL26074344 0.80 LMNA (0.74) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17688884 0.80 LMNA (0.66) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22601533 0.77 LMNA (0.71) LMNASMN1; SMN2NPC1RAB9AALDH1A1

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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 HEPAGENE THERAPEUTICS, INC. (VG) 2020-10-29 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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 ATF1, ERN1, MAP3K1 LMNA 3233/4885SMN1; SMN2 3406/4885NPC1 1692/4885

“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.