SCHEMBL8024070

SCHEMBL8024070

Nc1cc(C=O)c(N)cc1C=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ERN1 O75460 9/20 0.36
PTK2 Q05397 1/20 0.35
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 1/20 0.32
HPGD P15428 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
SCHEMBL14695048 0.94 PTK2 (0.47) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL8024078 0.90 PTK2 (0.41) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL22302452 0.84 ERN1 (0.43) ERN1TRIM24TRIM33
SCHEMBL8444257 0.84 TSHR (0.52) TDP1ALDH1A1TSHRKDM4EERN1
SCHEMBL3197190 0.83 ERN1 (0.41) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL15713801 0.81 ERN1 (0.40) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL2307383 0.81 GAA (0.46) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL3204262 0.81 TSHR (0.48) TDP1ALDH1A1TSHRLMNAMEN1
SCHEMBL24389243 0.79 ALDH1A1 (0.57) TDP1ALDH1A1TSHRLMNAKDM4E
SCHEMBL29077012 0.79 CA12 (0.36) TSHRERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4000187-A THERMAL STABILITY, COATINGS, CAST FILMS UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 1976-12-28 US claimed
EP-0444142-B1 POLYQUINOLINE COPOLYMERS HITACHI CHEMICAL CO LTD (JP) 2000-03-29 EP disclosed
US-5723573-A ACETYLENIC END GROUPS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-03-03 US disclosed
US-5017677-A Molding materials, laminates, adhesives, films and fibers COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1991-05-21 US disclosed
US-4000187-A THERMAL STABILITY, COATINGS, CAST FILMS UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 1976-12-28 US disclosed