SCHEMBL8324003

SCHEMBL8324003

N#Cc1nccc2c1ccn2-c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.36
CDK2 P24941 1/20 0.36
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP3A4 P08684 2/20 0.34
LMNA P02545 2/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
NR1I2 O75469 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34

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
SCHEMBL8323616 0.86 GABRA2 (0.40) CDC7CDK2KDM4EALDH1A1MAPT
SCHEMBL8320585 0.84 CDC7 (0.39) CDC7CDK2KDM4EALDH1A1MAPT
SCHEMBL8319454 0.79 MAT2A (0.42) CDC7CDK2KDM4EALDH1A1MAPT
SCHEMBL8323045 0.72 CDC7 (0.40) CDC7CDK2ALDH1A1MAPT
SCHEMBL8323009 0.70 HSD17B10 (0.42) ALDH1A1MAPTNPSR1CYP3A4L3MBTL1
SCHEMBL8323244 0.69 RECQL (0.36) CDC7CDK2ALDH1A1MAPTGABRP
SCHEMBL8324428 0.66 RECQL (0.51) KDM4EALDH1A1MAPTNPSR1CYP3A4
SCHEMBL7713066 0.65 GABRA2 (0.50) KDM4EALDH1A1MAPTCYP3A4LMNA
SCHEMBL10348129 0.65 ALDH1A1 (0.42) KDM4EALDH1A1MAPTLMNAGAA
SCHEMBL8671264 0.64 MAPT (0.58) KDM4EALDH1A1MAPTNPSR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0729470-B1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LTD (GB) 1999-05-12 EP claimed
US-5451566-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES ZENECA LIMITED (GB) 1995-09-19 US claimed
WO-1995014019-A1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LIMITED (GB) 1995-05-26 WO claimed
EP-0729470-B1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LTD (GB) 1999-05-12 EP disclosed
US-5451566-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES ZENECA LIMITED (GB) 1995-09-19 US disclosed
WO-1995014019-A1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LIMITED (GB) 1995-05-26 WO disclosed
US-5395553-A Liquid crystalline compounds, liquid crystal compositions containing the same and use thereof DAISO CO., LTD. (JP) 1995-03-07 US disclosed
EP-0410447-B1 Liquid crystalline compounds, liquid crystal compositions containing the same and use thereof DAISO CO LTD (JP) 1994-11-17 EP disclosed
US-5338482-A Liquid crystalline compounds, liquid crystal compositions containing the same and use thereof DAISO CO., LTD. (JP) 1994-08-16 US disclosed
US-5324450-A Stable optically active glycidyl ether derivatives DAISO CO., LTD. (JP) 1994-06-28 US disclosed
US-5308540-A REACTING AN OPTICALLY ACTIVE GLYCIDYL ETHER WITH A MALONATE IN THE PRESENCE OF A BASE IN AN ORGANIC SOLVENT TO PRODUCE A COMPOUND HAVING AN OPTICALLY ACTIVE LACTONE RING DAISO CO., LTD. (JP) 1994-05-03 US disclosed
EP-0306919-B1 LIQUID CRYSTALLINE COMPOUNDS AND PROCESS FOR PRODUCTION THEREOF DAISO CO., LTD. (JP) 1993-02-17 EP disclosed
US-5026506-A High capacity displays SHARP KABUSHIKI KAISHA (JP) 1991-06-25 US disclosed
EP-0410447-A2 Liquid crystalline compounds, liquid crystal compositions containing the same and use thereof DAISO CO., LTD. (JP) 1991-01-30 EP disclosed
US-4909957-A Containing lactone ring structure DAISO CO., LTD. (JP) 1990-03-20 US disclosed