SCHEMBL24433764

SCHEMBL24433764

CNC(=N)NC(=N)N(C)CCc1cc(CNC(=N)NC(=N)NCCc2cccs2)cs1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 8/20 0.39
NPC1 O15118 5/20 0.33
RAB9A P51151 5/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
OPRM1 P35372 1/20 0.33
HSD11B1 P28845 1/20 0.33
BRD4 O60885 1/20 0.32
LMNA P02545 2/20 0.32
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
GHSR Q92847 1/20 0.32
MAPT P10636 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL14868726 0.82 HSD11B1 (0.44) ADAM17RAB9AHSD11B1LMNAMAPT
SCHEMBL24433656 0.80 OPRM1 (0.32) OPRM1
SCHEMBL14868680 0.78 NPC1 (0.50) ADAM17NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL14868724 0.74 ADAM17 (0.52) ADAM17NPC1RAB9ASMN1; SMN2OPRM1
SCHEMBL14868612 0.72 HSD11B1 (0.46) NPC1RAB9ASMN1; SMN2HSD11B1MAPT
SCHEMBL14868577 0.71 POLB (0.50) RAB9ASMN1; SMN2LMNAMAPTHPGD
SCHEMBL14868701 0.69 HSD11B1 (0.45) ADAM17HSD11B1LMNATAAR1
SCHEMBL19164890 0.69 ADAM17 (0.39) ADAM17NPC1RAB9ASMN1; SMN2OPRM1
SCHEMBL21984537 0.69
Hydrochloric Acid SCHEMBL28170304 0.68 RAB9A (0.49) ADAM17NPC1RAB9ASMN1; SMN2OPRM1

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-11759441-B2 Biguanide compositions and methods of treating metabolic disorders ANJI PHARMACEUTICALS INC. (US) 2023-09-19 US disclosed
US-20220151957-A1 BIGUANIDE COMPOSITIONS AND METHODS OF TREATING METABOLIC DISORDERS ANJI PHARMACEUTICALS INC. 2022-05-19 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 (2 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-11759441-B2 Biguanide compositions and methods of treating metabolic disorders SLC5A2, SLC5A1, GPR119 ADAM17 4004/4885NPC1 405/4885RAB9A 2425/4885
US-20220151957-A1 BIGUANIDE COMPOSITIONS AND METHODS OF TREATING METABOLIC DISORDERS SLC5A2, SLC5A1, GPR119 ADAM17 4004/4885NPC1 405/4885RAB9A 2425/4885

“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.