SCHEMBL9019949

SCHEMBL9019949

O=C1CCn2nccc2N1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CRBN Q96SW2 11/20 0.40
CYP11B2 P19099 3/20 0.39
DDB1 Q16531 9/20 0.38
CYP11B1 P15538 2/20 0.35
GAA P10253 2/20 0.33
ALOX5 P09917 1/20 0.32
G6PD P11413 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
ABCC9 O60706 1/20 0.31
ABCC8 Q09428 1/20 0.31
KCNJ11 Q14654 1/20 0.31
KCNJ8 Q15842 1/20 0.31

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
SCHEMBL23256252 0.89 NPC1 (0.37) NPC1LMNARAB9ASMN1; SMN2CRBN
SCHEMBL909830 0.68 NPC1 (0.44) NPC1LMNARAB9ASMN1; SMN2CRBN
SCHEMBL25792210 0.67 NPC1 (0.54) NPC1LMNARAB9ASMN1; SMN2CRBN
SCHEMBL13114252 0.67 CYP11B2 (0.57) NPC1LMNARAB9ASMN1; SMN2CRBN
SCHEMBL15473978 0.65
SCHEMBL1713993 0.65 CRBN (0.37) NPC1LMNARAB9ASMN1; SMN2CRBN
SCHEMBL3980439 0.65 MAPT (0.36) LMNARAB9AALOX12
SCHEMBL24439824 0.64 KDM4E (0.32)
SCHEMBL3710781 0.64
SCHEMBL24800708 0.63 CYP11B2 (0.50) NPC1LMNARAB9ASMN1; SMN2CRBN

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4161494-A1 NITROGEN-CONTAINING FUSED BICYCLIC COMPOUNDS AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS KSQ Therapeutics, Inc. (US) 2023-04-12 EP disclosed
US-9844553-B2 Pyrazolopyridyl compounds as aldosterone synthase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-12-19 US disclosed
US-20170020879-A1 PYRAZOLOPYRIDYL COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC 2017-01-26 US disclosed
EP-0332156-B1 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1996-12-18 EP disclosed
US-5366970-A Cephem compounds and pharmaceutically acceptable salts thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-22 US disclosed
US-5173485-A Bactericides, microbiocides FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-12-22 US disclosed
EP-0332156-A2 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-09-13 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-20170020879-A1 PYRAZOLOPYRIDYL COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS CYP21A2, CYP11B2, CYP11B1 NPC1 1320/4885LMNA 2356/4885RAB9A 4124/4885

“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.