SCHEMBL16037019

SCHEMBL16037019

CS(=O)(=O)c1ccccc1-c1c(C(=O)O)cccc1-c1cc[nH]n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
MYC P01106 1/20 0.38
BCAT2 O15382 1/20 0.37
HNF4A P41235 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
ATR Q13535 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
ALOX15 P16050 1/20 0.35
KEAP1 Q14145 2/20 0.35

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
SCHEMBL14918727 0.80 HNF4A (0.49) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL14919171 0.79 MEN1 (0.51) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL1535274 0.77 RAB9A (0.46) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL16037020 0.77 ALDH1A1 (0.37) ALDH1A1LMNABCAT2CA1CA2
SCHEMBL16038153 0.76 TSHR (0.48) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL16039155 0.75 AGTR2 (0.41)
SCHEMBL29073837 0.75 ALDH1A1 (0.41) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL14918728 0.75 HNF4A (0.53) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL28684912 0.72 DHODH (0.39) ALDH1A1L3MBTL1LMNAMAPTMYC
SCHEMBL14918607 0.71 TP53 (0.53) ALDH1A1L3MBTL1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140275049-A1 SUBSTITUTED PYRAZOLE ANALOGS As RAR ANTAGONISTS ELI LILLY AND COMPANY 2014-09-18 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-20140275049-A1 SUBSTITUTED PYRAZOLE ANALOGS As RAR ANTAGONISTS RARB, RARA, RARG ALDH1A1 113/4885L3MBTL1 4725/4885LMNA 4594/4885

“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.