SCHEMBL126610

SCHEMBL126610

C[C@@H]1CC[C@H](C)N1C(=O)Nc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.56
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP1A2 P05177 1/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 3/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.47
PKM P14618 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
CYP2C9 P11712 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL14638491 1.00 NAMPT (0.56) NAMPTALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL1412504 1.00 NAMPT (0.56) NAMPTALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL4898206 1.00 NAMPT (0.56) NAMPTALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL11145541 0.80 NPC1 (0.54) ALDH1A1KDM4ECYP2C19NPC1RAB9A
SCHEMBL18642083 0.78 MAPT (0.47) NAMPTALDH1A1CYP2C19NPC1RAB9A
SCHEMBL31234028 0.77 SMN1; SMN2 (0.67) NAMPTALDH1A1KDM4ECYP2C19NPC1
SCHEMBL11833345 0.76 LMNA (0.79) ALDH1A1KDM4ECYP2C19CYP1A2NPC1
SCHEMBL20432655 0.76 FAAH (0.65) KDM4ENPC1RAB9ASMN1; SMN2TP53
SCHEMBL20420962 0.75 FAAH (0.51) KDM4ENPC1RAB9ATP53MAPT
SCHEMBL22635896 0.75 ALDH1A1 (0.53) ALDH1A1KDM4ECYP1A2NPC1RAB9A

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

Appears in 3616 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024110852-A1 A HERBICIDAL COMPOSITION AND A PROCESS FOR PREPARING THE SAME THEREOF UPL LIMITED (IN) 2024-05-30 WO claimed
US-20230139897-A1 SOLID HERBICIDE COMPOSITION AND THE USE THEREOF ROTAM AGROCHEM INTERNATIONAL COMPANY LIMITED (HK) 2023-05-04 US claimed
EP-4125382-A1 HERBICIDAL COMBINATION UPL Corporation Limited (MU) 2023-02-08 EP claimed
US-20230000079-A1 COMBINATION COMPRISING A TRIKETONE HERBICIDE AND A DIPHENYLETHER HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION Generic Crop Science LLC (US) 2023-01-05 US claimed
US-20210378241-A1 COMBINATION COMPRISING A BENZAMIDE HERBICIDE AND A PYRIDINE CARBOXYLIC ACID HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION Generic Crop Science LLC (US) 2021-12-09 US claimed
WO-2021191618-A1 HERBICIDAL COMBINATION UPL Corporation Limited (MU) 2021-09-30 WO claimed
EP-3884778-A1 HERBICIDAL COMBINATION UPL Corporation Limited (MU) 2021-09-29 EP claimed
EP-3407717-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2021-07-28 EP claimed
CN-108697091-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2021-07-23 CN claimed
CN-108697081-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2021-07-23 CN claimed
US-8288318-B2 2-(poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2012-10-16 US claimed
US-20120195974-A1 CONTROLLING MEALYBUGS DOW AGROSCIENCES LLC (US) 2012-08-02 US claimed
WO-2012103393-A2 CONTROLLING MEALYBUGS DOW AGROSCIENCES LLC (US) 2012-08-02 WO claimed
WO-2012061290-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 WO claimed
WO-2012061288-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 WO claimed
US-20120110701-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-03 US claimed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 US claimed
US-20110190133-A1 2-(POLY-SUBSTITUTED ARYL)-6-AMINO-5-HALO-4-PYRIMIDINECARBOXYLIC ACIDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC 2011-08-04 US claimed
WO-2010022251-A2 GABA/PESTICIDAL COMBINATIONS PLANT HEALTH CARE, INC. (US) 2010-02-25 WO claimed
US-20100048397-A1 GABA/Pesticidal Combinations PLANT HEALTH CARE, INC. 2010-02-25 US claimed