SCHEMBL6487064

SCHEMBL6487064

Cn1c(-c2ccccc2)c(C=CC(=O)NCc2ccccc2F)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 4/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
KDM4E B2RXH2 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 5/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
TEK Q02763 1/20 0.41
CNR2 P34972 1/20 0.41
POLB P06746 1/20 0.41
HK1 P19367 1/20 0.39
HKDC1 Q2TB90 1/20 0.39

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
SCHEMBL6487054 1.00 ALDH1A1 (0.48) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6488719 0.88 GAA (0.53) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6488724 0.88 GAA (0.53) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6487393 0.86 KMT2A (0.50) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6487398 0.86 KMT2A (0.50) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6487521 0.84 ALDH1A1 (0.46) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6487526 0.84 ALDH1A1 (0.46) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6486265 0.83 KMT2A (0.55) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6486271 0.83 KMT2A (0.55) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL6478631 0.81 ALDH1A1 (0.48) ALDH1A1LMNAMAPTRAB9ANPC1

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-20050014942-A1 Transforming growth factor inhibitor; controllign cell differentiation, cell proliferation NIPPON SHINYAKU CO., LTD. (JP) 2005-01-20 US disclosed
EP-1452525-A1 AMIDE DERIVATIVES AND DRUGS Nippon Shinyaku Co., Ltd. (JP) 2004-09-01 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-20050014942-A1 Transforming growth factor inhibitor; controllign cell differentiation, cell proliferation TGFBR1, TGFBR2, TGFB1 ALDH1A1 2521/4885LMNA 2502/4885MAPT 4750/4885

“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.