SCHEMBL7727062

SCHEMBL7727062

CCc1ccc2ncc(N)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.48
KMT2A Q03164 7/20 0.48
ALDH1A1 P00352 7/20 0.48
MEN1 O00255 6/20 0.48
RAB9A P51151 5/20 0.48
HPGD P15428 5/20 0.48
NPC1 O15118 4/20 0.48
LMNA P02545 2/20 0.48
GAA P10253 2/20 0.48
PTK2B Q14289 1/20 0.48
PDE10A Q9Y233 1/20 0.46
KDM4E B2RXH2 5/20 0.44
MAPT P10636 5/20 0.44
HSD17B10 Q99714 3/20 0.44
TP53 P04637 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
NOS3 P29474 1/20 0.43
NOS1 P29475 1/20 0.43

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
SCHEMBL7729942 0.86 RAB9A (0.44) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL16541640 0.85 NPC1 (0.49) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL7730991 0.83 TLR8 (0.50) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL20524060 0.82 EGFR (0.41) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL23330368 0.81 KDM4E (0.40) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL5799847 0.81 NOS1 (0.41) SMN1; SMN2ALDH1A1PDE10AKDM4EMAPT
SCHEMBL14084759 0.80 CYP1A2 (0.53) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL22276493 0.79 CYP1A2 (0.41) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL18563403 0.79 CYP1A2 (0.41) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A
SCHEMBL11162210 0.78 EGFR (0.61) SMN1; SMN2KMT2AALDH1A1MEN1RAB9A

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-20250171431-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE HORIZON THERAPEUTICS IRELAND DAC (IE) 2025-05-29 US disclosed
WO-2025030163-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE HORIZON THERAPEUTICS IRELAND DAC (IE) 2025-02-06 WO disclosed
US-6399629-B1 PYRROLIDINES AND PIPERIDINES FOR TREATING MICROBIAL INFECTIONS BY REDUCING EXPORT OF COADMINISTERED ANTIMICROBIAL AGENT OR COMPOUND SYNTHESIZED BY MICROBES FOR THEIR GROWTH; REDUCING IN VIVO AVAILABILITY MICROCIDE PHARMACEUTICALS, INC. 2002-06-04 US disclosed
WO-2000001714-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-01-13 WO 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-20250171431-A1 HETEROCYCLIC INHIBITORS OF IGF-1R FOR TREATMENT OF DISEASE IGF1R, TRHR, TSHR SMN1; SMN2 4102/4885KMT2A 3997/4885ALDH1A1 1694/4885

“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.