SCHEMBL8024078

SCHEMBL8024078

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.41
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
ERN1 O75460 9/20 0.35
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
HPGD P15428 1/20 0.30

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 0.91 PTK2 (0.47) PTK2TDP1ALDH1A1TSHRKDM4E
SCHEMBL8024070 0.90 TDP1 (0.40) PTK2TDP1ALDH1A1TSHRKDM4E
SCHEMBL4941671 0.82 PIM1 (0.39) ALDH1A1KDM4EMEN1KMT2AERN1
SCHEMBL3197190 0.80 ERN1 (0.41) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL15713801 0.78 ERN1 (0.40) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL3204262 0.78 TSHR (0.48) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL2307383 0.78 GAA (0.46) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL29955145 0.77 ALDH1A1 (0.63) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL22302452 0.76 ERN1 (0.43) ERN1TRIM24TRIM33
SCHEMBL8444257 0.76 TSHR (0.52) TDP1ALDH1A1TSHRKDM4EERN1

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 12 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
EP-0394846-B1 Organic photochromic compound SEIKISUI CHEMICAL CO LTD (JP) 1995-06-14 EP disclosed
US-5091535-A ORGANIC PHOTOCHROMIC COMPOUND, A DIMER OF PYRIDO QUINOLINE SEIKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-02-25 US disclosed
EP-0444142-A4 POLYQUINOLINE COPOLYMERS 1991-10-16 EP disclosed
EP-0444142-A1 POLYQUINOLINE COPOLYMERS HITACHI CHEMICAL CO., LTD. (JP) 1991-09-04 EP disclosed
US-5017677-A Molding materials, laminates, adhesives, films and fibers COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1991-05-21 US disclosed
EP-0394846-A2 Organic photochromic compound SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-10-31 EP disclosed
WO-1990005754-A1 POLYQUINOLINE COPOLYMERS COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1990-05-31 WO disclosed
US-4240791-A REDUCTION OF VAT OR SULFUR DYE TO LEUCO DYE WITH THIOUREA DIOXIDE IN PRESENCE OF DIALDEHYDE TOKAI DENKA KOGYO KABUSHIKI KAISHA (JP) 1980-12-23 US disclosed
US-4000187-A THERMAL STABILITY, COATINGS, CAST FILMS UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 1976-12-28 US disclosed