SCHEMBL15540959

SCHEMBL15540959

CCOC(=O)[C@]1(C)C[C@H]1c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
GAA P10253 1/20 0.54
TSHR P16473 1/20 0.45
OPRM1 P35372 5/20 0.44
TP53 P04637 1/20 0.44
DHFR P00374 1/20 0.44
OPRD1 P41143 3/20 0.43
OPRK1 P41145 3/20 0.43
SLC22A1 O15245 1/20 0.43
SLC6A4 P31645 1/20 0.43
ADRA1A P35348 1/20 0.43
KCNH2 Q12809 1/20 0.43
KDM1A O60341 3/20 0.43
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADORA3 P0DMS8 1/20 0.43

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
SCHEMBL17785187 1.00 SMN1; SMN2 (0.54) SMN1; SMN2GAATSHROPRM1TP53
SCHEMBL16455156 0.85 OPRM1 (0.45) SMN1; SMN2GAAOPRM1KDM1AHTT
SCHEMBL29354473 0.85 OPRM1 (0.45) SMN1; SMN2GAAOPRM1KDM1AHTT
SCHEMBL28558069 0.83 SMN1; SMN2 (0.56) SMN1; SMN2GAATSHROPRM1DHFR
SCHEMBL7394507 0.80 SMN1; SMN2 (0.56) SMN1; SMN2GAATSHROPRM1DHFR
SCHEMBL28433212 0.80 SMN1; SMN2 (0.53) SMN1; SMN2GAATSHROPRM1DHFR
SCHEMBL7394508 0.80 SMN1; SMN2 (0.56) SMN1; SMN2GAATSHROPRM1DHFR
SCHEMBL7394511 0.80 SMN1; SMN2 (0.56) SMN1; SMN2GAATSHROPRM1DHFR
SCHEMBL903428 0.80 GAA (0.53) SMN1; SMN2GAAKDM1AMAOAMAOB
SCHEMBL15767768 0.80 GAA (0.53) SMN1; SMN2GAAKDM1AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2867226-B1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2018-11-14 EP disclosed
US-9815819-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2017-11-14 US disclosed
US-9815819-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2017-11-14 US disclosed
US-9815819-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2017-11-14 US disclosed
US-20150141455-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-21 US disclosed
US-20150141455-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-21 US disclosed
US-20150141455-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-21 US disclosed
EP-2867226-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF Novartis AG (CH) 2015-05-06 EP disclosed
WO-2014002051-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2014-01-03 WO 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-20150141455-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF C5, C3AR1, C9 SMN1; SMN2 3532/4885GAA 2984/4885TSHR 2347/4885

“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.