SCHEMBL3753723

SCHEMBL3753723

c1ccc2sc(-c3cc4ncccc4s3)nc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.60
NPC1 O15118 10/20 0.60
KDM4E B2RXH2 10/20 0.60
ALDH1A1 P00352 8/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
TP53 P04637 3/20 0.60
HSD17B10 Q99714 3/20 0.60
TSHR P16473 1/20 0.60
L3MBTL1 Q9Y468 4/20 0.58
MAPT P10636 5/20 0.53
HPGD P15428 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
PPARG P37231 1/20 0.53
NCOA2 Q15596 1/20 0.53
NCOA1 Q15788 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
POLB P06746 2/20 0.52
CYP19A1 P11511 1/20 0.51
MEN1 O00255 4/20 0.49

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
SCHEMBL21132825 0.83 RAB9A (0.55) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL28017683 0.82 ALOX5 (0.43) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19961704 0.81 RAB9A (0.59) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL29386742 0.81 RAB9A (0.59) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4824051 0.77 IKBKB (0.46) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL7845853 0.77 CYP19A1 (0.44) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4934482 0.77 CYP19A1 (0.73) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL31324900 0.77 CYP19A1 (0.44) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL3761425 0.76 RAB9A (0.55) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL10297868 0.76 NPC1 (0.76) RAB9ANPC1KDM4EALDH1A1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298370-A1 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF RIMONYX PHARMACEUTICALS LTD. (IL) 2010-11-25 US disclosed
US-20100298370-A1 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF RIMONYX PHARMACEUTICALS LTD. (IL) 2010-11-25 US disclosed
WO-2008020438-A3 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF RIMONYX PHARMACEUTICALS LTD (IL) 2009-04-30 WO disclosed
WO-2008020438-A2 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF RIMONYX PHARMACEUTICALS LTD (IL) 2008-02-21 WO disclosed
WO-2008020438-A2 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF RIMONYX PHARMACEUTICALS LTD (IL) 2008-02-21 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-20100298370-A1 BENZOTHIAZOLYL THIENOPYRIDINE DERIVATIVES AND USES THEREOF HPSE, HDGF, HPGDS RAB9A 3598/4885NPC1 4731/4885KDM4E 3176/4885

“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.