SCHEMBL7698338

SCHEMBL7698338

c1ccc([C@@H]2NCCc3ccccc32)nc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.59
PRCP P42785 8/20 0.57
GAA P10253 2/20 0.56
GID4 Q8IVV7 1/20 0.48
MAPT P10636 2/20 0.44
SLC22A1 O15245 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL7702387 1.00 RECQL (0.59) RECQLPRCPGAAGID4MAPT
SCHEMBL5023257 1.00 RECQL (0.59) RECQLPRCPGAAGID4MAPT
SCHEMBL6659680 0.83 TRPM5 (0.41) RECQLPRCPMAPTMEN1KMT2A
SCHEMBL5022581 0.83 RECQL (0.59) RECQLPRCPGAAGID4MAPT
SCHEMBL5022576 0.83 RECQL (0.59) RECQLPRCPGAAGID4MAPT
SCHEMBL7700195 0.82 PRCP (0.48) RECQLPRCPGAAMAPTMEN1
SCHEMBL7703323 0.82 TRPM5 (0.57) RECQLPRCPGAAMAPTHTR2A
SCHEMBL7703320 0.82 TRPM5 (0.57) RECQLPRCPGAAMAPTHTR2A
SCHEMBL7700199 0.82 PRCP (0.48) RECQLPRCPGAAMAPTMEN1
SCHEMBL7703317 0.82 TRPM5 (0.57) RECQLPRCPGAAMAPTHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901488-B1 2,4-DIAMINOPYRIMIDINE DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2002-11-06 EP disclosed
EP-0901488-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-03-17 EP disclosed
US-5866583-A Substituted 2,4-diaminopyrimidines HOFFMANN-LA ROCHE INC. (US) 1999-02-02 US disclosed
WO-1997043277-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-11-20 WO disclosed