SCHEMBL9634749

SCHEMBL9634749

Cc1c[nH]c(=O)nc1C1C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADRB1 P08588 1/20 0.37
DNMT1 P26358 1/20 0.37
TK1 P04183 2/20 0.34
TK2 O00142 1/20 0.34
SLC5A2 P31639 1/20 0.34
GALR3 O60755 1/20 0.33
NR2F2 P24468 1/20 0.33
ALOX12 P18054 1/20 0.33
ADRA1A P35348 1/20 0.33
OGA O60502 2/20 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
SCHEMBL9633782 1.00 LMNA (0.37) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL8356828 0.76 ADRB1 (0.38) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL17384668 0.75 TK1 (0.38) LMNASMN1; SMN2TK1TK2SLC5A2
SCHEMBL16631950 0.74 TK1 (0.39) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL8927834 0.74 LMNA (0.38) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL27165201 0.74 ADRB1 (0.41) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL9751247 0.74 ADRB1 (0.38) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL8663124 0.74 ADRB1 (0.38) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL8961007 0.71 DNMT1 (0.35) LMNASMN1; SMN2ADRB1DNMT1TK1
SCHEMBL8698135 0.71 DNMT1 (0.35) LMNASMN1; SMN2ADRB1DNMT1TK1

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
US-5126439-A Complementary purines and pyrimidines TEMPLE UNIVERSITY (US) 1992-06-30 US disclosed
EP-0333832-B1 ARTIFICIAL DNA BASE PAIR ANALOGUES TEMPLE UNIVERSITY (US) 1992-06-03 EP disclosed
EP-0333832-A1 ARTIFICIAL DNA BASE PAIR ANALOGUES TEMPLE UNIVERSITY (US) 1989-09-27 EP disclosed
WO-1989002921-A1 ARTIFICIAL DNA BASE PAIR ANALOGUES TEMPLE UNIVERSITY (US) 1989-04-06 WO disclosed