SCHEMBL13802949

SCHEMBL13802949

N#Cc1ccc(NCCO)nc1NCCN

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 4/20 0.45
▸ CDK2 P24941 4/20 0.45
▸ CCNA1 P78396 4/20 0.45
▸ EGFR P00533 2/20 0.45
▸ CHUK O15111 1/20 0.44
▸ KDM4E B2RXH2 7/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ AURKA O14965 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SMARCA2 P51531 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MBOAT4 Q96T53 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34

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
SCHEMBL13802923 0.93 CCNA2 (0.47) CCNA2CDK2CCNA1EGFRCHUK
SCHEMBL3599527 0.77 HRH3 (0.38) CCNA2CDK2CCNA1EGFRCHUK
Hydrochloric Acid SCHEMBL1119496 0.76 HRH3 (0.37) CCNA2CDK2CCNA1EGFRKDM4E
SCHEMBL30656353 0.70 CCNA2 (0.63) CCNA2CDK2CCNA1EGFRCHUK
SCHEMBL6697261 0.68 NPC1 (0.58) CCNA2CDK2CCNA1EGFRCHUK
SCHEMBL3111473 0.68 NPC1 (0.58) KDM4EALDH1A1HPGDPOLBLMNA
SCHEMBL10490498 0.68 POLB (0.47) KDM4EALDH1A1HPGDPOLBLMNA
SCHEMBL1142962 0.68 ALDH1A1 (0.44) KDM4EALDH1A1HPGDPOLBLMNA
SCHEMBL10490530 0.68 POLB (0.47) KDM4EALDH1A1HPGDPOLBLMNA
Hydrochloric Acid SCHEMBL6441990 0.67 NPC1 (0.57) KDM4EALDH1A1HPGDPOLBLMNA

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-20090142554-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-06-04 — — US disclosed
US-20090142554-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-06-04 — — US disclosed
WO-2007045829-A2 YELLOW AZO DYES FOR INK JET PRINTING FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-04-26 — — WO 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-20090142554-A1 Yellow Azo Dyes for Ink Jet Printing NR4A3, NR4A1, NR2E3 CCNA2 807/4885CDK2 844/4885CCNA1 1123/4885

“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.

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