SCHEMBL12759082

SCHEMBL12759082

CC(Cc1ccc(S(=O)(=O)O)cc1)P(C1CCCCC1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TP53 P04637 2/20 0.35
HSD17B10 Q99714 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
USP30 Q70CQ3 1/20 0.34
EPHX1 P07099 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 1/20 0.34
F2 P00734 1/20 0.33

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
SCHEMBL12759079 0.78 EPHX2 (0.38) ALDH1A1HSD17B10TSHRHTTMAPK1
SCHEMBL12759095 0.77 SIGMAR1 (0.42)
SCHEMBL6266176 0.71 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL3008249 0.70 ALDH1A1 (0.49) ALDH1A1TP53HSD17B10MEN1KMT2A
SCHEMBL12453115 0.70 DAO (0.43) ALDH1A1MEN1KMT2AHTTLMNA
SCHEMBL656154 0.69 KMT2A (0.44) ALDH1A1MEN1KMT2ATSHRHTT
SCHEMBL29285318 0.69 TAAR1 (0.57)
SCHEMBL19457401 0.69 LMNA (0.43) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL775989 0.69 LMNA (0.43) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL7735405 0.68 DAO (0.41) ALDH1A1MEN1KMT2ATSHRLMNA

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-8466306-B2 Sulfonated organophosphine compounds and use in hydroformylation processes DOW GLOBAL TECHNOLOGIES LLC (US) 2013-06-18 US disclosed
US-8466306-B2 Sulfonated organophosphine compounds and use in hydroformylation processes DOW GLOBAL TECHNOLOGIES LLC (US) 2013-06-18 US disclosed
US-20110054203-A1 SULFONATED ORGANOPHOSPHINE COMPOUNDS AND USE IN HYDROFORMYLATION PROCESSES DOW GLOBAL TECHNOLOGIES INC. (US) 2011-03-03 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-20110054203-A1 SULFONATED ORGANOPHOSPHINE COMPOUNDS AND USE IN HYDROFORMYLATION PROCESSES ORMDL3, IP6K3, ALK ALDH1A1 573/4885TP53 3958/4885HSD17B10 1745/4885

“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.