SCHEMBL2287307

SCHEMBL2287307

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[S@@+](CC[C@H](N)C(=O)O)Cc2ccccc2)[C@@H](O)[C@H]1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 6/20 0.73
AMD1 P17707 2/20 0.73
NNMT P40261 5/20 0.66
DOT1L Q8TEK3 5/20 0.65
PCMT1 P22061 3/20 0.65
NSD2 O96028 3/20 0.65
SETD7 Q8WTS6 3/20 0.65
PRMT5 O14744 3/20 0.65
PRMT1 Q99873 3/20 0.65
EHMT2 Q96KQ7 3/20 0.65
NSD3 Q9BZ95 2/20 0.65
TRDMT1 O14717 2/20 0.65
INMT O95050 2/20 0.65
METTL3 Q86U44 2/20 0.65
EHMT1 Q9H9B1 2/20 0.65
METTL14 Q9HCE5 2/20 0.65
RNMT O43148 1/20 0.65
TPMT P51580 1/20 0.65
NSD1 Q96L73 1/20 0.65
SETD2 Q9BYW2 1/20 0.65

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
SCHEMBL2287296 1.00 CARM1 (0.73) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL2287316 1.00 CARM1 (0.73) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL12378915 1.00 CARM1 (0.73) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL31425158 0.93 CARM1 (0.70) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL2287080 0.88 CARM1 (0.81) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL30930805 0.88 CARM1 (0.78) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL2287090 0.88 CARM1 (0.81) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL2287096 0.88 CARM1 (0.81) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL30965845 0.88 CARM1 (0.78) CARM1AMD1NNMTDOT1LPCMT1
SCHEMBL2284764 0.87 CARM1 (0.79) CARM1AMD1NNMTDOT1LPCMT1

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
US-8008007-B2 S-adenosyl-L-methionine analogs with extended activated groups for transfer by methyltransferases RWTH AACHEN (DE) 2011-08-30 US disclosed
EP-1874790-B1 NEW S-ADENOSYL-L-METHIONINE ANALOGS WITH EXTENDED ACTIVATED GROUPS FOR TRANSFER BY METHYLTRANSFERASES RWTH AACHEN (DE) 2010-08-18 EP disclosed
US-20090018101-A1 S-ADENOSYL-L-METHIONINE ANALOGS WITH EXTENDED ACTIVATED GROUPS FOR TRANSFER BY METHYLTRANSFERASES RWTH AACHEN (DE) 2009-01-15 US disclosed
EP-1874790-A2 NEW S-ADENOSYL-L-METHIONINE ANALOGS WITH EXTENDED ACTIVATED GROUPS FOR TRANSFER BY METHYLTRANSFERASES RWTH Aachen (DE) 2008-01-09 EP disclosed
WO-2006108678-A2 NEW S-ADENOSYL-L-METHIONINE ANALOGS WITH EXTENDED ACTIVATED GROUPS FOR TRANSFER BY METHYLTRANSFERASES RWTH AACHEN (DE) 2006-10-19 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 (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-20090018101-A1 S-ADENOSYL-L-METHIONINE ANALOGS WITH EXTENDED ACTIVATED GROUPS FOR TRANSFER BY METHYLTRANSFERASES BHMT2, MSRB3, PRMT3 CARM1 35/4885AMD1 20/4885NNMT 21/4885

“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.