SCHEMBL3794372

SCHEMBL3794372

O=C(CC12CC3CC(CC(C3)C1)C2)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
P2RX7 Q99572 7/20 0.39
EPHX2 P34913 3/20 0.37
LMNA P02545 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 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
SCHEMBL3790171 0.85 KDM4E (0.40) KMT2ALMNAALDH1A1
Adamantane SCHEMBL3794380 0.83 MEN1 (0.31) MEN1KMT2AALDH1A1HTT
SCHEMBL3794378 0.78 KMT2A (0.40) MEN1KMT2AP2RX7EPHX2LMNA
SCHEMBL11991284 0.76 LMNA (0.38) MEN1KMT2AEPHX2LMNACA12
SCHEMBL3786558 0.74 KMT2A (0.35) MEN1KMT2ALMNACA12ALDH1A1
SCHEMBL242790 0.72 P2RX7 (0.36) MEN1KMT2AP2RX7EPHX2CA12
SCHEMBL515601 0.72 P2RX7 (0.37) MEN1KMT2AP2RX7EPHX2CA12
SCHEMBL19529502 0.71 ALDH1A1 (0.42) MEN1KMT2AP2RX7EPHX2LMNA
SCHEMBL24861662 0.70 ALDH1A1 (0.42) MEN1KMT2AEPHX2LMNAALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL3420430 0.69 P2RX7 (0.38) MEN1KMT2AP2RX7EPHX2ALDH1A1

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-8283104-B2 Sulfonate and its derivative, photosensitive acid generator, and resist composition and patterning process using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-10-09 US disclosed
US-20100209827-A1 NOVEL SULFONATE AND ITS DERIVATIVE, PHOTOSENSITIVE ACID GENERATOR, AND RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-08-19 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-20100209827-A1 NOVEL SULFONATE AND ITS DERIVATIVE, PHOTOSENSITIVE ACID GENERATOR, AND RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME DAP3, MRPS23, ASIC3 MEN1 4475/4885KMT2A 2736/4885P2RX7 1456/4885

“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.