SCHEMBL31058769

SCHEMBL31058769

O=C(Nc1ccccc1)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 6/20 0.78
MEN1 O00255 2/20 0.76
KMT2A Q03164 2/20 0.76
RXFP1 Q9HBX9 1/20 0.76
PYGL P06737 8/20 0.72
NPC1 O15118 2/20 0.71
RAB9A P51151 2/20 0.71
LMNA P02545 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
TP53 P04637 1/20 0.71
POLB P06746 1/20 0.71
F7 P08709 1/20 0.63
F3 P13726 1/20 0.63
GUSB P08236 1/20 0.62

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
SCHEMBL6398652 0.88 NHERF1 (0.63) NHERF1MEN1KMT2ARXFP1PYGL
SCHEMBL6400080 0.84 NHERF1 (0.58) NHERF1MEN1KMT2ARXFP1PYGL
SCHEMBL16627058 0.84 NPC1 (0.78) NHERF1MEN1KMT2ARXFP1PYGL
SCHEMBL2760086 0.84 NPC1 (0.73) NHERF1MEN1KMT2ARXFP1NPC1
SCHEMBL29475123 0.83 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2TP53
SCHEMBL7208136 0.83 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2TP53
SCHEMBL5405858 0.83 NHERF1 (0.67) NHERF1MEN1KMT2ARXFP1PYGL
SCHEMBL27385788 0.83 NPC1 (0.71) NHERF1MEN1KMT2ARXFP1PYGL
SCHEMBL2735818 0.83 NPC1 (0.71) NHERF1MEN1KMT2ARXFP1NPC1
SCHEMBL14845689 0.83 TP53 (1.00) RXFP1NPC1RAB9ALMNASMN1; SMN2

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-20240325326-A1 METHOD OF TREATING PULMONARY FIBROSIS BY TARGETING GLYCOGEN UTILIZATION UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2024-10-03 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-20240325326-A1 METHOD OF TREATING PULMONARY FIBROSIS BY TARGETING GLYCOGEN UTILIZATION GYS1, GYS2, AGL NHERF1 1171/4885MEN1 4736/4885KMT2A 3731/4885

“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.