SCHEMBL4490724

SCHEMBL4490724

CC(C)(C)[Si](C)(C)n1ccc2cc3c(cc21)OCO3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 1/20 0.38
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
FGFR1 P11362 1/20 0.33
PGR P06401 1/20 0.33
AR P10275 1/20 0.33
GABRA1 P14867 1/20 0.33
MAOA P21397 1/20 0.33
SLC6A2 P23975 1/20 0.33
PDE4A P27815 1/20 0.33
KDR P35968 1/20 0.33
GABRB2 P47870 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CMA1 P23946 1/20 0.33
ALDH1A1 P00352 3/20 0.32
OGA O60502 2/20 0.32
LTB4R Q15722 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
CASP3 P42574 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
SCHEMBL6851122 0.73 PIK3CB (0.44) TFPI2USP2MAPTKMT2AFGFR1
SCHEMBL31615173 0.73 PIK3CB (0.44) TFPI2USP2MAPTKMT2AFGFR1
SCHEMBL993855 0.71 KCNH2 (0.44) TFPI2MAPTSLC6A2ALDH1A1KDM4E
SCHEMBL4488558 0.71 HTR2C (0.42) MAPTARSLC6A2
SCHEMBL6625111 0.69 TFPI2 (0.40) TFPI2MAPTFGFR1GABRA1GABRB2
SCHEMBL4504386 0.69 HTR2A (0.44) TFPI2MAPTKMT2ANPSR1RAB9A
SCHEMBL4478439 0.68 CDC7 (0.43) ALDH1A1KDM4E
SCHEMBL28191216 0.68 CA1 (0.36)
SCHEMBL23956116 0.64 HTR2C (0.60)
SCHEMBL30839297 0.64 HTR2C (0.42) TFPI2KMT2AKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615898-B1 2-Aminopyrimidine derivatives and their medical use NOVARTIS AG (CH) 2014-10-29 EP disclosed
US-7615562-B2 Such as 2-methyl-4-{5-[2-(2,2,6,6-tetramethyl-piperidin-4-ylamino)-pyrimidin-4-yl]-thiophen-2-yl}-butan-2-ol; tumor necrosis factor inhibitors; immunosuppressants; antiinflammatory agents NOVARTIS AG (CH) 2009-11-10 US disclosed
US-20070043048-A1 2-Aminopyrimidine derivatives and their medical use NOVARTIS AG (CH) 2007-02-22 US disclosed
EP-1615898-A1 2-AMINOPYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE Novartis AG (CH) 2006-01-18 EP disclosed
WO-2004089913-A1 AMINOPYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE NOVARTIS AG (CH) 2004-10-21 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-20070043048-A1 2-Aminopyrimidine derivatives and their medical use TPMT, IKBKB, CHUK TFPI2 210/4885USP2 2459/4885MAPT 3501/4885

“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.