SCHEMBL9877100

SCHEMBL9877100

CNc1ccccc1N(C)N=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
MAPT P10636 5/20 0.39
POLB P06746 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
RECQL P46063 4/20 0.39
USP2 O75604 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
ALOX15 P16050 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
RGS12 O14924 2/20 0.39
THRB P10828 2/20 0.39
PKM P14618 2/20 0.39
NFKB1 P19838 2/20 0.39
APEX1 P27695 2/20 0.39
BRCA1 P38398 2/20 0.39
BLM P54132 2/20 0.39
GNAI1 P63096 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL4146720 0.80 ALDH1A1 (0.48) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL31718394 0.76 KDM1A (0.47) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL20830555 0.76 MAPT (0.44) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL6568199 0.76 KDM1A (0.47) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL1072174 0.72 ALDH1A1 (0.42) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL29728715 0.72 ALDH1A1 (0.42) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL27647094 0.72 MAPT (0.41) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL17850566 0.72 MAPT (0.41) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL24505979 0.72 MAPT (0.38) ALDH1A1MAPTPOLBTDP1RECQL
SCHEMBL673129 0.71 ALDH1A1 (0.41) ALDH1A1MAPTPOLBTDP1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001171-A Process, modified rubbers and rubber compositions BRIDGESTONE/FIRESTONE, INC. (US) 1991-03-19 US disclosed
EP-0319733-A2 Process, modified rubbers and rubber compositions THE FIRESTONE TIRE & RUBBER COMPANY (US) 1989-06-14 EP disclosed
US-4788229-A BLENDING MIXTURES OF UNCURED ELASTOMERS AND FILLERS CONTAINING ELASTOMER-FILLER LINKAGE PROMOTERS; TIRES; FRICTION RESISTANCE; REDUCED HYSTERESIS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1988-11-29 US disclosed