SCHEMBL5484147

SCHEMBL5484147

CC(=O)Nc1ccn[c]c1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
POLB P06746 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MAPT P10636 1/20 0.37
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
CYP2C19 P33261 2/20 0.35
TOP2A P11388 1/20 0.35
HSD17B10 Q99714 2/20 0.34
GAA P10253 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
SCHEMBL5476616 0.81 HTT (0.47) ALDH1A1HDAC1CA1CA2CA9
SCHEMBL2067008 0.79 KDM4E (0.40) ALDH1A1HPGDMEN1KMT2ACA1
SCHEMBL2067156 0.76 ALDH1A1 (0.41) ALDH1A1HPGDMEN1KMT2ANPC1
SCHEMBL5484141 0.75 ADORA3 (0.37) ALDH1A1HPGDMEN1KMT2AHDAC1
SCHEMBL2067230 0.75
SCHEMBL3754761 0.73 KDM4E (0.45) ALDH1A1HPGDMEN1KMT2AHDAC1
SCHEMBL2066555 0.72 KMT2A (0.44) ALDH1A1HPGDMEN1KMT2ARAB9A
SCHEMBL5475470 0.69 ALDH1A1 (0.48) ALDH1A1HPGDMEN1KMT2AHDAC1
SCHEMBL1430982 0.69 HDAC1 (0.46) ALDH1A1HPGDHDAC1HDAC6CA1
SCHEMBL9450132 0.69 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same DAIICHI PHARMACEUTICAL CO., LTD. 2007-09-06 US disclosed
EP-1731513-A1 PHENOXYACETIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-13 EP 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-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same PPARA, PPARG, PPARD ALDH1A1 620/4885HPGD 976/4885MEN1 4790/4885

“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.