SCHEMBL6490384

SCHEMBL6490384

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

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.66
LMNA P02545 1/20 0.66
HSD17B10 Q99714 2/20 0.52
CYP2C19 P33261 1/20 0.52
TEK Q02763 1/20 0.52
MAPT P10636 4/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 1/20 0.51
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.48
HK1 P19367 1/20 0.48
HKDC1 Q2TB90 1/20 0.48
HPGD P15428 1/20 0.48
PIK3CA P42336 1/20 0.46
MTOR P42345 1/20 0.46

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
SCHEMBL6490375 1.00 ALDH1A1 (0.66) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL6478384 0.91 ALDH1A1 (0.55) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL6478378 0.91 ALDH1A1 (0.55) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1872407 0.90 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1872405 0.90 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1884536 0.87 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL30522261 0.86 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1883788 0.86 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1879533 0.86 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10CYP2C19TEK
SCHEMBL1879716 0.85 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10CYP2C19TEK

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
EP-1666440-B1 METHOD FOR PRODUCING AROMATIC UNSATURATED COMPOUND SUMITOMO CHEMICAL CO (JP) 2014-01-22 EP disclosed
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 2502/4885HSD17B10 2194/4885

“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.