SCHEMBL25545696

SCHEMBL25545696

CCOC(=O)/N=C(\N)c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
USP2 O75604 1/20 0.44
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
LMNA P02545 1/20 0.43
MAOA P21397 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
CYP2D6 P10635 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL10943611 0.86 MEN1 (0.50) L3MBTL1SMN1; SMN2MAPTALDH1A1NPC1
Hydrochloric Acid SCHEMBL9617121 0.85 MEN1 (0.49) L3MBTL1SMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL12560522 0.84 LMNA (0.43) L3MBTL1SMN1; SMN2NPC1RAB9ACYP1A2
SCHEMBL18300754 0.83 LMNA (0.38) L3MBTL1POLBMAPTALDH1A1CYP1A2
SCHEMBL14338510 0.81 TDP1 (0.54) L3MBTL1SMN1; SMN2POLBNPC1RAB9A
SCHEMBL21597111 0.76 AURKA (0.52) SMN1; SMN2POLBMAPTKDM4EALDH1A1
SCHEMBL8645754 0.75 MAPK1 (0.48) POLBMAPTALDH1A1NPC1RAB9A
SCHEMBL18300258 0.74 CA12 (0.33) L3MBTL1SMN1; SMN2POLBMAPTCYP1A2
SCHEMBL17517937 0.74 TSHR (0.40) L3MBTL1SMN1; SMN2POLBMAPTALDH1A1
SCHEMBL8645750 0.73 HSD17B2 (0.43) POLBMAPTALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230158006-A1 USE OF DIRECT THROMBIN INHIBITORS IN THE TREATMENT OF NEURODEGENERATIVE DISEASES GRAMMAS PAULA (US) 2023-05-25 US disclosed
US-20230158006-A1 USE OF DIRECT THROMBIN INHIBITORS IN THE TREATMENT OF NEURODEGENERATIVE DISEASES GRAMMAS PAULA (US) 2023-05-25 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-20230158006-A1 USE OF DIRECT THROMBIN INHIBITORS IN THE TREATMENT OF NEURODEGENERATIVE DISEASES TFPI, TFPI2, PLAT L3MBTL1 3201/4885SMN1; SMN2 351/4885POLB 2974/4885

“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.