SCHEMBL162342

SCHEMBL162342

[c]1nnc2ccccc2c1-c1nc2ccccc2s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.45
NPC1 O15118 10/20 0.45
KDM4E B2RXH2 9/20 0.45
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
TP53 P04637 2/20 0.45
HSD17B10 Q99714 2/20 0.45
TSHR P16473 1/20 0.45
MAPT P10636 6/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
GAA P10253 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
APP P05067 3/20 0.44
GLA P06280 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
NPSR1 Q6W5P4 2/20 0.43

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
SCHEMBL6006385 0.76 NQO1 (0.44) APP
SCHEMBL5744633 0.74 RAB9A (0.47) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL827403 0.73 RAB9A (0.67) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL16062228 0.72 PDPK1 (0.43) RAB9ANPC1KDM4EMAPTL3MBTL1
SCHEMBL2225061 0.71 KDM4E (0.64) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30689066 0.71 KDM4E (0.64) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
Hydrogen Sulfide SCHEMBL16859912 0.71 RAB9A (0.64) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4574523 0.71 RAB9A (0.42) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8327904 0.71 RAB9A (0.44) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL3144177 0.71 RAB9A (0.46) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2

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 200 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160135464-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-05-19 US claimed
US-20150197514-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2015-07-16 US claimed
EP-2809159-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2014-12-10 EP claimed
EP-2809160-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2014-12-10 EP claimed
US-20140274688-A1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-09-18 US claimed
EP-2731430-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2014-05-21 EP claimed
EP-2672819-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2013-12-18 EP claimed
WO-2013116053-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 WO claimed
WO-2013116052-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 WO claimed
US-20130203592-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 US claimed
US-20130203593-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 US claimed
WO-2013019824-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-02-07 WO claimed
WO-2013009791-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 WO claimed
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 US claimed
WO-2012109125-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-08-16 WO claimed
US-20120202687-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC 2012-08-09 US claimed
US-20230203026-A1 PESTICIDAL COMPOSITIONS AND METHODS CORTEVA AGRISCIENCE LLC (US) 2023-06-29 US disclosed
US-11332452-B2 Pesticidal compositions and methods CORTEVA AGRISCIENCE LLC (US) 2022-05-17 US disclosed
WO-2009017951-A2 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2009-02-05 WO disclosed
US-20090029863-A1 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2009-01-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090029863-A1 PESTICIDES AND USES THEREOF ACHE, DDT, BCHE RAB9A 1087/4885NPC1 3567/4885KDM4E 1260/4885
US-20160135464-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CYP19A1, CYP1A1, AR RAB9A 591/4885NPC1 3670/4885KDM4E 3406/4885
US-20230203026-A1 PESTICIDAL COMPOSITIONS AND METHODS ACHE, DDT, PLA2G2D RAB9A 393/4885NPC1 3343/4885KDM4E 1659/4885
US-20150197514-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, CAT RAB9A 277/4885NPC1 3651/4885KDM4E 2745/4885
US-11332452-B2 Pesticidal compositions and methods ACHE, DDT, PLA2G2D RAB9A 393/4885NPC1 3343/4885KDM4E 1659/4885
US-20130203593-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CYP19A1, CYP1A1, AR RAB9A 591/4885NPC1 3670/4885KDM4E 3406/4885
US-20140274688-A1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO ACHE, DDT, MLYCD RAB9A 449/4885NPC1 3002/4885KDM4E 1689/4885
US-20120202687-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CYP19A1, CYP1A1, AR RAB9A 591/4885NPC1 3670/4885KDM4E 3406/4885
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, CAT RAB9A 277/4885NPC1 3651/4885KDM4E 2745/4885
US-20130203592-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CYP19A1, CYP1A1, AR RAB9A 591/4885NPC1 3670/4885KDM4E 3406/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.