SCHEMBL24329367

SCHEMBL24329367

O=C(Nc1nc2cccnc2s1)c1ccn(C2CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.43
POLB P06746 3/20 0.41
NPC1 O15118 11/20 0.40
RAB9A P51151 11/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
HTT P42858 6/20 0.40
PKM P14618 3/20 0.40
MAPT P10636 5/20 0.39
OPRK1 P41145 2/20 0.39
AGTR1 P30556 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL26603055 0.83 POLB (0.48) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL24329372 0.78 ROCK2 (0.48) HCRTR1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL24329695 0.77 RAB9A (0.60) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL24329832 0.76 NPC1 (0.44) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL24329370 0.75 NPC1 (0.43) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL185171 0.70 DYRK1A (0.60) POLBNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL24329369 0.70 NPC1 (0.53) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL24435037 0.68 TP53 (0.47) POLBNPC1RAB9ASMN1; SMN2HTT
SCHEMBL22578811 0.67 ACKR3 (0.41) SMN1; SMN2MAPTALDH1A1KDM4EACKR3
SCHEMBL21209601 0.67 ACKR3 (0.41) POLBNPC1RAB9AALDH1A1HPGD

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 3 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
WO-2022082071-A1 SMALL MOLECULE MODULATORS OF GP130 SIGNALING PATHWAYS, TOPICAL FORMULATIONS AND METHOD OF US THEREOF CARTHRONIX, INC. (US) 2022-04-21 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-20230382903-A1 SMALL MOLECULE MODULATORS OF GP130 SIGNALING PATHWAYS, TOPICAL FORMULATIONS AND METHOD OF USE THEREOF STAT1, STAT3, STAT6 HCRTR1 1908/4885POLB 3295/4885NPC1 2133/4885

“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.