SCHEMBL5656308

SCHEMBL5656308

Nc1ccc(CSc2ncccn2)cc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.68
MAPK1 P28482 1/20 0.67
RAB9A P51151 8/20 0.50
NPC1 O15118 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
KMT2A Q03164 4/20 0.49
MAPT P10636 4/20 0.49
MEN1 O00255 3/20 0.49
HPGD P15428 1/20 0.49
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
PKM P14618 1/20 0.44
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
ALOX15 P16050 1/20 0.42
HSP90AA1 P07900 1/20 0.41
HTT P42858 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
SCHEMBL1029180 0.81 HSD17B10 (1.00) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL5106178 0.80 MAPK1 (1.00) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6268245 0.80 HSD17B10 (0.68) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL5658909 0.79 MAPT (0.64) HSD17B10RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL6267072 0.79 HSD17B10 (0.73) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL27584295 0.77 RAB9A (0.41) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL4318069 0.76 HSD17B10 (0.61) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL27764910 0.75 L3MBTL1 (0.59) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6640402 0.74 HSD17B10 (0.70) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL1750521 0.74 POLB (0.69) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2

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-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 EP 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 HSD17B10 691/4885MAPK1 1752/4885RAB9A 2546/4885

“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.