SCHEMBL432189

SCHEMBL432189

O=C1CCC[C@@H](C2CCCCC2)N1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.34
PKM P14618 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
CRBN Q96SW2 2/20 0.33
MAPK1 P28482 1/20 0.33
OPRM1 P35372 2/20 0.33
OPRL1 P41146 2/20 0.33
OPRK1 P41145 1/20 0.32
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
KMT2A Q03164 1/20 0.31
OR51E2 Q9H255 1/20 0.31
CTSD P07339 1/20 0.30
PARP1 P09874 1/20 0.30
FKBP5 Q13451 1/20 0.30

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
SCHEMBL432190 1.00 MAPT (0.35) MAPTALDH1A1PKMLMNATSHR
SCHEMBL3053407 0.98 ALDH1A1 (0.36) MAPTALDH1A1PKMLMNATSHR
SCHEMBL6652266 0.96 KMT2A (0.35) MAPTALDH1A1PKMLMNATSHR
SCHEMBL17338063 0.93 ALDH1A1 (0.36) MAPTALDH1A1PKMLMNATSHR
SCHEMBL9517429 0.93 CRBN (0.35) ALDH1A1PKMLMNATSHRCRBN
SCHEMBL9733421 0.91 MAPT (0.35) MAPTALDH1A1PKMLMNATSHR
SCHEMBL9733418 0.91 MAPT (0.35) MAPTALDH1A1PKMLMNATSHR
SCHEMBL18150856 0.89 SRD5A1 (0.37) MAPTALDH1A1PKMLMNATSHR
SCHEMBL3046579 0.89 ALDH1A1 (0.36) MAPTALDH1A1PKMLMNATSHR
SCHEMBL6638258 0.89 ALDH1A1 (0.36) MAPTALDH1A1PKMLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9498483-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2016-11-22 US disclosed
US-9498483-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2016-11-22 US disclosed
US-9498483-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2016-11-22 US disclosed
US-20150224109-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2015-08-13 US disclosed
US-20150224109-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2015-08-13 US disclosed
US-20150224109-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2015-08-13 US disclosed
US-9040690-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2015-05-26 US disclosed
US-9040690-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2015-05-26 US disclosed
US-9040690-B2 2,3,5-trisubstituted thiophene compounds and uses thereof NOVARTIS AG (CH) 2015-05-26 US disclosed
EP-2595983-A1 2,3,5-TRISUBSTITUTED THIOPHENE COMPOUNDS AND USES THEREOF Novartis AG (CH) 2013-05-29 EP disclosed
US-20130123252-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2013-05-16 US disclosed
US-20130123252-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2013-05-16 US disclosed
US-20130123252-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof NOVARTIS AG (CH) 2013-05-16 US disclosed
WO-2012010663-A9 2,3,5-TRISUBSTITUTED THIOPHENE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2013-01-24 WO disclosed
WO-2012010663-A1 2,3,5-TRISUBSTITUTED THIOPHENE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2012-01-26 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 (2 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-20150224109-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof TPMT, CYP3A5, CYP11B2 MAPT 2512/4885ALDH1A1 283/4885PKM 1690/4885
US-20130123252-A1 2,3,5-Trisubstituted Thiophene Compounds and Uses Thereof TPMT, CYP3A5, CYP11B2 MAPT 2512/4885ALDH1A1 283/4885PKM 1690/4885

“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.