SCHEMBL24958732

SCHEMBL24958732

CC(C)c1ncc(-c2ccccn2)s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.57
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
MAPT P10636 3/20 0.57
GLA P06280 2/20 0.57
LMNA P02545 3/20 0.45
POLB P06746 2/20 0.45
CCR1 P32246 2/20 0.45
CCR5 P51681 2/20 0.45
CCR8 P51685 2/20 0.45
CYP1A2 P05177 1/20 0.45
METAP1 P53582 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 1/20 0.45
DOHH Q9BU89 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
ATM Q13315 1/20 0.44
ALOX5 P09917 1/20 0.43
HTT P42858 3/20 0.42
HDAC3 O15379 1/20 0.41

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
SCHEMBL2754041 0.79 KDR (0.49)
SCHEMBL20809152 0.78 KDM4E (0.61) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL11994384 0.77 HDAC1 (0.33) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL10131283 0.76 KDM4E (0.64) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL24956343 0.76 ALDH1A1 (0.39) KDM4ENPC1RAB9ACYP1A2HTT
SCHEMBL13615880 0.76 ASIC3 (0.46) KDM4EMAPTMAPK14ALDH1A1TDP1
SCHEMBL15858751 0.76 TGFBR1 (0.34) KDM4EMAPTMAPK14ALDH1A1TDP1
SCHEMBL21610561 0.76 ALDH1A1 (0.31) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL12920024 0.75 HPGDS (0.49) NPC1RAB9ACYP1A2ALDH1A1
SCHEMBL13625437 0.75 KDM4E (0.52) KDM4ENPC1RAB9AMAPTGLA

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-20230021705-A1 GLP-1R MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2023-01-26 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-20230021705-A1 GLP-1R MODULATING COMPOUNDS GLP1R, GIPR, GPR119 KDM4E 2322/4885NPC1 1188/4885RAB9A 478/4885

“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.