SCHEMBL3099989

SCHEMBL3099989

CCn1c(-c2ccc(Cl)cc2)nn(C)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
GFER P55789 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CNR1 P21554 2/20 0.45
NOTUM Q6P988 1/20 0.45
NR1H3 Q13133 2/20 0.43
ALDH1A1 P00352 3/20 0.43
NR1H2 P55055 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
S1PR2 O95136 1/20 0.40
TDP2 O95551 1/20 0.40
S1PR4 O95977 1/20 0.40
RAF1 P04049 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL9198835 0.85 NR1H3 (0.49) LMNAGFERAPOBEC3GTDP1CNR1
SCHEMBL9354103 0.81 ALDH1A1 (0.55) CNR1NR1H3ALDH1A1NR1H2MEN1
SCHEMBL8235257 0.79 AVPR2 (0.46) LMNAGFERAPOBEC3GTDP1CNR1
SCHEMBL9259478 0.79 NOTUM (0.50) LMNACNR1NOTUMNR1H3ALDH1A1
Dimethylamine SCHEMBL7655386 0.79 ADORA2B (0.43) LMNANR1H3ALDH1A1NR1H2KDM4E
SCHEMBL9184719 0.78 LMNA (0.42) LMNAGFERAPOBEC3GTDP1CNR1
SCHEMBL9181039 0.76 LMNA (0.40) LMNAGFERAPOBEC3GTDP1CNR1
SCHEMBL8233071 0.75 TSHR (0.61) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL10486744 0.72 APOBEC3G (0.55) LMNAGFERAPOBEC3GTDP1CNR1
SCHEMBL8233155 0.72 APOBEC3G (0.68) LMNAGFERAPOBEC3GTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5436252-A Antiischemic agents, stroke, Alzheimer's or Parkinson's diseases MERRELL DOW PHARMACEUTICALS INC. (US) 1995-07-25 US claimed
US-4946856-A 5-phenyl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL DOW PHARMACEUTICALS INC. (US) 1990-08-07 US claimed
US-20100234402-A1 METHODS AND COMPOSITIONS FOR TREATING SPINAL MUSCULAR ATROPHY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2010-09-16 US disclosed
WO-2008150509-A1 METHODS AND COMPOSITIONS FOR TREATING SPINAL MUSCULAR ATROPHY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2008-12-11 WO disclosed
US-20060286167-A1 Compositions and methods for the treatment of neurodegenerative diseases STAUNTON JANE 2006-12-21 US disclosed
US-20060270742-A1 Compositions and methods for the treatment of neurodegenerative diseases COMBINATORX, INC. 2006-11-30 US disclosed
WO-2006119329-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES COMBINATORX, INCORPORATED (US) 2006-11-09 WO disclosed
US-5436252-A Antiischemic agents, stroke, Alzheimer's or Parkinson's diseases MERRELL DOW PHARMACEUTICALS INC. (US) 1995-07-25 US disclosed
EP-0273310-B1 5-Aryl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL DOW PHARMA (US) 1995-06-21 EP disclosed
EP-0273309-B1 5-Aryl-3H-1,2,4-triazol-3-ones and their use in the treatment of neurodegenerative disorders MERRELL DOW PHARMA (US) 1995-01-11 EP disclosed
US-4946856-A 5-phenyl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL DOW PHARMACEUTICALS INC. (US) 1990-08-07 US disclosed
EP-0280867-A1 Process for the preparation of 5-aryl-2,4-dialkyl-3H-1,2,4-triazole-3-thiones MERRELL DOW PHARMACEUTICALS INC. (US) 1988-09-07 EP disclosed
EP-0273310-A2 5-Aryl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL PHARMACEUTICALS INC. (US) 1988-07-06 EP disclosed
EP-0273309-A2 5-Aryl-3H-1,2,4-triazol-3-ones and their use in the treatment of neurodegenerative disorders MERRELL DOW PHARMACEUTICALS INC. (US) 1988-07-06 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-20060270742-A1 Compositions and methods for the treatment of neurodegenerative diseases PSEN2, PSEN1, HTT LMNA 166/4885GFER 3274/4885APOBEC3G 411/4885

“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.