SCHEMBL26884200

SCHEMBL26884200

Cn1ccc(C(=O)Nc2nc3c(s2)CNCC3)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.44
▸ NPC1 O15118 9/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ GCK P35557 1/20 0.42
▸ CHKA P35790 1/20 0.42
▸ SMN1; SMN2 Q16637 7/20 0.42
▸ TP53 P04637 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ PKM P14618 3/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ ROCK2 O75116 1/20 0.41
▸ ROCK1 Q13464 1/20 0.41
▸ MAPT P10636 6/20 0.40
▸ NFKB1 P19838 4/20 0.40
▸ NFKB2 Q00653 4/20 0.40
▸ RELA Q04206 4/20 0.40
▸ GAA P10253 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40

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
SCHEMBL26884193 0.91 RAB9A (0.44) RAB9ANPC1KMT2ASMN1; SMN2TP53
SCHEMBL26884196 0.81 NPC1 (0.58) RAB9ANPC1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL26884191 0.79 RAB9A (0.48) RAB9ANPC1KMT2ASMN1; SMN2TP53
SCHEMBL330155 0.75 TSHR (0.46) RAB9ANPC1GCKCHKASMN1; SMN2
Hydrochloric Acid SCHEMBL20764968 0.74 TSHR (0.44) RAB9ANPC1GCKCHKASMN1; SMN2
SCHEMBL12307415 0.73 TSHR (0.43) RAB9ANPC1KMT2AGCKCHKA
SCHEMBL26884258 0.73 RAB9A (0.45) RAB9ANPC1KMT2AGCKSMN1; SMN2
SCHEMBL980111 0.73 MAPT (0.52) RAB9ANPC1KMT2ACHKASMN1; SMN2
SCHEMBL15012213 0.73 CHKA (0.45) RAB9ANPC1KMT2AGCKCHKA
SCHEMBL24329828 0.69 RAB9A (0.44) RAB9ANPC1KMT2ASMN1; SMN2TP53

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-20230382903-A1 SMALL MOLECULE MODULATORS OF GP130 SIGNALING PATHWAYS, TOPICAL FORMULATIONS AND METHOD OF USE THEREOF CARTHRONIX INC (US) 2023-11-30 — — US disclosed
US-20230382903-A1 SMALL MOLECULE MODULATORS OF GP130 SIGNALING PATHWAYS, TOPICAL FORMULATIONS AND METHOD OF USE THEREOF CARTHRONIX INC (US) 2023-11-30 — — 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-20230382903-A1 SMALL MOLECULE MODULATORS OF GP130 SIGNALING PATHWAYS, TOPICAL FORMULATIONS AND METHOD OF USE THEREOF STAT1, STAT3, STAT6 RAB9A 3504/4885NPC1 2133/4885KMT2A 4379/4885

“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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