SCHEMBL8330359

SCHEMBL8330359

CC(=O)N1CCC2(CCN(C)C2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 6/20 0.54
CYP1A2 P05177 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 4/20 0.50
CYP2D6 P10635 4/20 0.50
HSD17B10 Q99714 4/20 0.50
CYP2C19 P33261 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPK1 P28482 1/20 0.49
CYP3A4 P08684 4/20 0.47
HIF1A Q16665 2/20 0.47
TSHR P16473 6/20 0.46
CYP2C9 P11712 5/20 0.46
KDM4E B2RXH2 1/20 0.43
HPGD P15428 2/20 0.43
OPRM1 P35372 1/20 0.43
OPRL1 P41146 1/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL18711889 0.90 USP2 (0.49) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL17624331 0.89 KDM4E (0.56) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL19658449 0.88 CYP1A2 (0.46) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL23763347 0.88 CYP1A2 (0.52) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL15632465 0.87 CYP1A2 (0.62) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL19504703 0.83 OPRM1 (0.47) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL27007062 0.83 USP2 (0.54) USP2CYP1A2ALDH1A1CYP2D6HSD17B10
SCHEMBL26783934 0.82 USP2 (0.60) USP2CYP1A2TDP1ALDH1A1CYP2D6
SCHEMBL31008711 0.82 USP2 (0.53) USP2CYP1A2ALDH1A1CYP2D6HSD17B10
SCHEMBL18390599 0.81 CYP1A2 (0.54) USP2CYP1A2TDP1ALDH1A1CYP2D6

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
WO-2023096995-A1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(6-MEMBERED HETEROCYCLOALKYL)-2-METHYLPYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE ANALOGUES ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) 2023-06-01 WO disclosed
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2023-05-04 US disclosed
WO-2019046330-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
US-20090186889-A1 SPIRO-SUBSTITUTED PYRROLOPYRIMIDINES IRIE OSAMU 2009-07-23 US disclosed
US-20090186889-A1 SPIRO-SUBSTITUTED PYRROLOPYRIMIDINES IRIE OSAMU 2009-07-23 US disclosed
US-7531546-B2 Spiro-substituted pyrrolo[2,3-D]pyrimidines as cathepsin inhibitors NOVARTIS AG (CH) 2009-05-12 US disclosed
US-7531546-B2 Spiro-substituted pyrrolo[2,3-D]pyrimidines as cathepsin inhibitors NOVARTIS AG (CH) 2009-05-12 US disclosed
EP-1592426-B1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2007-12-19 EP disclosed
WO-2004069256-A1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2004-08-19 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-20090186889-A1 SPIRO-SUBSTITUTED PYRROLOPYRIMIDINES CTSS, CTSK, CTSZ USP2 4677/4885CYP1A2 2961/4885TDP1 2847/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 USP2 130/4885CYP1A2 4026/4885TDP1 1316/4885

“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.