SCHEMBL23808092

SCHEMBL23808092

CNC(=O)N1N=CCC1c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 16/20 0.65
▸ POLB P06746 1/20 0.64
▸ NPC1 O15118 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ MAPT P10636 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60

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
SCHEMBL23808154 0.85 NPC1 (0.52) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL23808090 0.84 RIPK1 (0.68) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL5527901 0.84 POLB (0.82) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL24351038 0.83 RIPK1 (0.70) RIPK1POLB
SCHEMBL9370156 0.83 RIPK1 (0.70) RIPK1POLB
SCHEMBL23808156 0.82 RIPK1 (0.55) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL23808123 0.82 ALDH1A1 (0.72) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL27276665 0.81 RIPK1 (0.71) RIPK1POLB
SCHEMBL23808158 0.80 RIPK1 (0.68) RIPK1POLBNPC1RAB9AMAPT
SCHEMBL23830945 0.80 RIPK1 (0.65) RIPK1POLBNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210284647-A1 N-(3-(IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR TREATING KINASE-RELATED DISEASES VORONOI CO., LTD (KR) 2021-09-16 — — 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-20210284647-A1 N-(3-(IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR TREATING KINASE-RELATED DISEASES MYLK3, MINK1, PLK2 RIPK1 33/4885POLB 1094/4885NPC1 4812/4885

“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.

Send feedback