SCHEMBL7526376

SCHEMBL7526376

CC(=O)c1cnc2sccc2c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.46
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 4/20 0.38
POLB P06746 3/20 0.38
MEN1 O00255 1/20 0.38
NSD2 O96028 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
MCL1 Q07820 1/20 0.38
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
MAP4K4 O95819 1/20 0.36
ABL1 P00519 1/20 0.36

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
SCHEMBL1901177 0.88 PKM (0.46) HTTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL30916871 0.79 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL6368861 0.79 ALDH1A1 (0.47) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL20509746 0.77 HTT (0.49) HTTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL26936985 0.75 MRGPRX1 (0.41) HTTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL13229696 0.73 MEN1 (0.40) HTTKDM4EALDH1A1POLBMEN1
SCHEMBL22120503 0.72 CHEK1 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL10741472 0.71 KMT2A (0.37) HTTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6707960 0.70 EGLN1 (0.49) HTTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9525340 0.70 HAVCR2 (0.48) HTTKDM4EALDH1A1MEN1MAPT

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-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-12-26 US disclosed
US-6437132-B2 INHIBITOR OF GONADOTROPIN RELEASING HORMONE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-20 US disclosed
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-02-14 US disclosed
US-6313301-B1 CYCLIZATION; LUTEINIZING HORMONE RELEASING HORMONE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-11-06 US disclosed
EP-1004585-A1 THIENOPYRIDINE DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESS FOR PRODUCING THE BOTH Takeda Chemical Industries, Ltd. (JP) 2000-05-31 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 (2 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-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 HTT 675/4885NPC1 3638/4885RAB9A 3584/4885
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 HTT 675/4885NPC1 3638/4885RAB9A 3584/4885

“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.