SCHEMBL27999697

SCHEMBL27999697

Nc1cnc2ccccc2n1.Nc1cnc2ccccc2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
KDM4E B2RXH2 4/20 0.52
HPGD P15428 4/20 0.52
MAPT P10636 4/20 0.52
HSD17B10 Q99714 3/20 0.52
GAA P10253 3/20 0.52
PDE10A Q9Y233 1/20 0.52
NCF1 P14598 1/20 0.50
NOS2 P35228 1/20 0.50
BACE1 P56817 1/20 0.50
NPC1 O15118 4/20 0.48
RAB9A P51151 3/20 0.48
PDPK1 O15530 2/20 0.48
GPR3 P46089 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
CASP1 P29466 1/20 0.47
MAPK10 P53779 1/20 0.47
CASP7 P55210 1/20 0.47
ALOX15 P16050 1/20 0.47
POLB P06746 2/20 0.46

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
SCHEMBL462847 1.00 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL29447182 1.00 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDMAPTHSD17B10
Hydrochloric Acid SCHEMBL27776055 0.98 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
Ammonia Solution, Strong SCHEMBL22288229 0.98 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
Bromide SCHEMBL7244276 0.98 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
Ammonia Solution, Strong SCHEMBL27825755 0.98 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
Benzene SCHEMBL28261497 0.98 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
Bromide SCHEMBL27818577 0.95 PDE10A (0.48) ALDH1A1KDM4EHPGDMAPTHSD17B10
Carbon Dioxide SCHEMBL28214588 0.91 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDMAPTHSD17B10
Urea SCHEMBL27360704 0.89 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153638-B Control of biuret in urea production 斯塔米卡邦有限公司 2019-10-01 CN disclosed
CN-106660948-B The method for preparing urea product 斯塔米卡邦有限公司 2019-06-04 CN disclosed
CN-109153638-A Control of Biuret in Urea Production 斯塔米卡邦有限公司 2019-01-04 CN disclosed
CN-109070043-A Urea production in the case where controlling biuret 斯塔米卡邦有限公司 2018-12-21 CN disclosed
CN-106660948-A Method of making urea product 斯塔米卡邦有限公司 2017-05-10 CN disclosed
CN-104324767-A PROCESS FOR CONTINUOUS PRODUCTION OF ORGANIC CARBONATES OR ORGANIC CARBAMATES AND SOLID CATALYSTS THEREFORE CATALYTIC DISTILLATION TECH 2015-02-04 CN disclosed