SCHEMBL26525864

SCHEMBL26525864

CCCCc1coc(-c2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.49
DRD4 P21917 2/20 0.49
DRD3 P35462 2/20 0.49
FFAR1 O14842 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL19876941 0.94 KCNH2 (0.50) DRD2DRD4DRD3
SCHEMBL12844627 0.90 DRD2 (0.51) DRD2DRD4DRD3FFAR1KDM4E
SCHEMBL5543626 0.83 DRD2 (0.49) DRD2DRD4DRD3FFAR1ALDH1A1
SCHEMBL12432902 0.82 DRD2 (0.54) DRD2DRD4DRD3FFAR1ALDH1A1
SCHEMBL5536850 0.82 DRD2 (0.48) DRD2DRD4DRD3FFAR1ALDH1A1
SCHEMBL27610597 0.80 NPC1 (0.45) NPC1MAPTRAB9A
SCHEMBL5106193 0.79 DRD2 (0.51) DRD2DRD4DRD3FFAR1ALDH1A1
SCHEMBL2225947 0.79 DRD2 (0.51) DRD2DRD4DRD3FFAR1ALDH1A1
SCHEMBL5541970 0.79 DRD2 (0.55) DRD2DRD4DRD3FFAR1KDM4E
SCHEMBL9282001 0.78 CYP1A2 (0.43) KDM4ENPC1ALDH1A1MAPTPKM

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-20230321091-A1 SUBSTITUTED PYRIDAZINONES FOR USE IN THE TREATMENT OF NEUROMUSCULAR DISEASES EDGEWISE THERAPEUTICS, INC. 2023-10-12 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-20230321091-A1 SUBSTITUTED PYRIDAZINONES FOR USE IN THE TREATMENT OF NEUROMUSCULAR DISEASES IL6, MUSK, SMN1; SMN2 DRD2 3243/4885DRD4 4199/4885DRD3 3268/4885

“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.