SCHEMBL7668372

SCHEMBL7668372

O=C(c1n[nH]c2ccccc12)c1n[nH]c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.66
YTHDC1 Q96MU7 1/20 0.66
STAT3 P40763 1/20 0.66
HIF1A Q16665 1/20 0.66
FLT3 P36888 2/20 0.62
CCNA2 P20248 1/20 0.62
CDK2 P24941 1/20 0.62
CCNA1 P78396 1/20 0.62
CTNNB1 P35222 3/20 0.60
WNT3A P56704 3/20 0.60
IDO1 P14902 1/20 0.58
NPC1 O15118 4/20 0.55
RAB9A P51151 3/20 0.55
EPHB3 P54753 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 1/20 0.54
FLT1 P17948 1/20 0.54
KDR P35968 1/20 0.54
PDPK1 O15530 1/20 0.52
CYP3A4 P08684 1/20 0.52

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
SCHEMBL31148407 1.00 KDM4E (0.66) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL5792748 0.89 CTNNB1 (0.67) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL5353834 0.86 FLT3 (0.65) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL29444537 0.86 FLT3 (0.65) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL42245 0.86 FLT3 (0.65) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL4469913 0.84 KDR (0.55) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL4469917 0.84 IDO1 (0.56) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL967165 0.84 KDM4E (0.62) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL591861 0.84 KDM4E (0.62) KDM4EYTHDC1STAT3HIF1AFLT3
SCHEMBL82761 0.84 KDM4E (0.62) KDM4EYTHDC1STAT3HIF1AFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117386893-A Multilayer composite antibacterial PE water supply pipeline and preparation process thereof 江苏惠升管业集团有限公司 2024-01-12 CN claimed
US-20130245033-A1 AMIDE COMPOUNDS GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2013-09-19 US claimed
US-9238643-B2 Amide compounds GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-01-19 US disclosed
CN-102558074-B Piperazine amide compound containing pyridazine substituent group GUANGZHOU INST BIOMED & HEALTH 2014-09-24 CN disclosed
CN-102382102-B Amide compound GUANGZHOU INST BIOMED & HEALTH 2014-01-08 CN disclosed
US-20130245033-A1 AMIDE COMPOUNDS GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2013-09-19 US disclosed
CN-101851211-B Piperazine amide compound JIANGSU CHIA TAI TIANQING PHAR 2013-08-14 CN disclosed
CN-102558074-A Piperazine amide compound containing pyridazine substituent group GUANGZHOU INST BIOMED & HEALTH 2012-07-11 CN disclosed
CN-102382102-A Amide compound GUANGZHOU INST BIOMED & HEALTH 2012-03-21 CN disclosed
CN-101851211-A Novel piperazine amide compound JIANGSU CHIA TAI TIANQING PHAR 2010-10-06 CN disclosed
US-6372778-B1 AMINE HYDROXYALKYL SULFONAMIDE AS ENZYME INHIBITORS VERTEX PHARMACEUTICALS, INCORPORATED 2002-04-16 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 (1 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-20130245033-A1 AMIDE COMPOUNDS AR, AVPR2, H1-0 KDM4E 2212/4885YTHDC1 2181/4885STAT3 374/4885

“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.