SCHEMBL12673167

SCHEMBL12673167

CN(CCn1cncn1)S(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
USP2 O75604 2/20 0.34
CYP19A1 P11511 2/20 0.33
KDM4E B2RXH2 2/20 0.33
FDPS P14324 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
TSHR P16473 2/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL10128343 0.82 EGLN3 (0.40) EGLN3SMN1; SMN2ALDH1A1MAPTUSP2
SCHEMBL6474806 0.77 EGLN3 (0.47) EGLN3SMN1; SMN2ALDH1A1MAPTCYP19A1
SCHEMBL25783566 0.75 EGLN3 (0.42) EGLN3SMN1; SMN2ALDH1A1MAPTCYP19A1
SCHEMBL22685288 0.70 EGLN3 (0.44) EGLN3SMN1; SMN2ALDH1A1MAPTUSP2
SCHEMBL27134470 0.70 EGLN3 (0.52) EGLN3SMN1; SMN2ALDH1A1MAPTCYP19A1
SCHEMBL27267342 0.70 EGLN3 (0.42) EGLN3SMN1; SMN2ALDH1A1MAPTCYP19A1
SCHEMBL12169671 0.69 TBXAS1 (0.46) EGLN3ALDH1A1CYP19A1FDPSHTT
SCHEMBL25784948 0.68 EGLN3 (0.39) EGLN3SMN1; SMN2ALDH1A1MAPTUSP2
SCHEMBL15490029 0.67 EGLN3 (0.45) EGLN3SMN1; SMN2ALDH1A1MAPTUSP2
SCHEMBL27134481 0.67 EGLN3 (0.48) EGLN3SMN1; SMN2ALDH1A1MAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9849107-B2 Compositions and methods for inhibiting cytochrome P450 SEQUOIA PHARMACEUTICALS, INC. (US) 2017-12-26 US disclosed
US-20170354636-A1 METHODS FOR INHIBITING TUMORS AND DRUG RESISTANCE SEQUOIA PHARMACEUTICALS INC (US) 2017-12-14 US disclosed
US-20160361287-A1 COMPOSITIONS AND METHODS FOR INHIBITING CYTOCHROME P450 SEQUOIA PHARMACEUTICALS, INC. 2016-12-15 US disclosed
US-9233952-B2 Compositions and methods for inhibiting cytochrome P450 SEQUOIA PHARMACEUTICALS, INC. (US) 2016-01-12 US disclosed
US-20150284352-A1 METHODS FOR INHIBITING DRUG DEGRADATION SEQUOIA PHARMACEUTICALS INC (US) 2015-10-08 US disclosed
US-8952056-B2 Methods for inhibiting drug degradation SEQUOIA PHARMACEUTICALS, INC. (US) 2015-02-10 US disclosed
US-8673970-B2 HIV protease inhibitor and cytochrome p450 inhibitor combinations SEQUOIA PHARMACEUTICALS, INC. (US) 2014-03-18 US disclosed
US-20140024671-A1 COMPOSITIONS AND METHODS FOR INHIBITING CYTOCHROME P450 SEQUOIA PHARMACEUTICALS INC (US) 2014-01-23 US disclosed
US-8481520-B2 Compositions and methods for inhibiting cytochrome P450 SEQUOIA PHARMACEUTICALS, INC. (US) 2013-07-09 US disclosed
US-20110112137-A1 HIV PROTEASE INHIBITOR AND CYTOCHROME P450 INHIBITOR COMBINATIONS SEQUOIA PHARMACEUTICALS, INC. (MD) 2011-05-12 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 (5 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-20160361287-A1 COMPOSITIONS AND METHODS FOR INHIBITING CYTOCHROME P450 CYP3A43, CYP2E1, CYP7A1 EGLN3 159/4885SMN1; SMN2 3320/4885ALDH1A1 363/4885
US-20170354636-A1 METHODS FOR INHIBITING TUMORS AND DRUG RESISTANCE HCCS, CYP2E1, CYP7A1 EGLN3 40/4885SMN1; SMN2 4787/4885ALDH1A1 308/4885
US-20110112137-A1 HIV PROTEASE INHIBITOR AND CYTOCHROME P450 INHIBITOR COMBINATIONS SERPINB1, CYP3A43, PREP EGLN3 268/4885SMN1; SMN2 4420/4885ALDH1A1 1471/4885
US-20140024671-A1 COMPOSITIONS AND METHODS FOR INHIBITING CYTOCHROME P450 CYP3A43, CYP2E1, CYP7A1 EGLN3 159/4885SMN1; SMN2 3320/4885ALDH1A1 363/4885
US-20150284352-A1 METHODS FOR INHIBITING DRUG DEGRADATION CYP2E1, CYP3A43, CYP3A5 EGLN3 105/4885SMN1; SMN2 3290/4885ALDH1A1 262/4885

“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.