SCHEMBL6633145

SCHEMBL6633145

CCOC(=O)c1cnc(SC)n2ncnc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.55
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
ADORA3 P0DMS8 1/20 0.54
ADORA2A P29274 1/20 0.54
ADORA1 P30542 1/20 0.54
CSNK1D P48730 2/20 0.50
ALDH1A1 P00352 6/20 0.46
MAPT P10636 3/20 0.46
HSD17B10 Q99714 3/20 0.45
HPGD P15428 2/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
POLB P06746 3/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL6632656 0.77 ADORA3 (0.50) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL6633419 0.74 CSNK1D (0.73) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL22932832 0.74 KDM4E (0.51) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL30781549 0.74 ADORA3 (0.49) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL6631279 0.73 ADORA3 (0.62) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL31682544 0.73 NPC1 (0.49) KDM4ENPC1RAB9ACSNK1DALDH1A1
SCHEMBL6633978 0.73 CSNK1D (0.72) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL10658769 0.72 ALDH1A1 (0.54) KDM4ENPC1RAB9ACSNK1DALDH1A1
SCHEMBL6632337 0.72 SMN1; SMN2 (0.50) KDM4ENPC1RAB9AADORA3ADORA2A
SCHEMBL9490199 0.71 ALDH1A1 (0.51) KDM4ENPC1RAB9ACSNK1DALDH1A1

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
EP-1430898-A1 RECEPTOR ANTAGONIST KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-06-23 EP disclosed
US-20040110826-A1 Receptor Antagonists KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-06-10 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-20040110826-A1 Receptor Antagonists ADRA2C, OPRL1, ADRB1 KDM4E 2973/4885NPC1 3041/4885RAB9A 314/4885

“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.