SCHEMBL29987340

SCHEMBL29987340

O=C(O)c1ccc(-n2cnc3cc(C(=O)O)ccc32)cc1

nearest known ligand 0.85

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 6/20 0.85
THRB P10828 1/20 0.74
HPGD P15428 6/20 0.74
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
HCAR3 P49019 1/20 0.57
GSK3B P49841 1/20 0.55
TSHR P16473 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.54
GAA P10253 1/20 0.54
RXRA P19793 1/20 0.53

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
SCHEMBL28685131 1.00 FGFR1 (0.85) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL4505231 0.92 FGFR1 (0.78) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL122653 0.92 FGFR1 (1.00) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL30343716 0.92 FGFR1 (1.00) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL2339316 0.91 FGFR1 (0.76) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL14065338 0.91 FGFR1 (0.76) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL121454 0.91 FGFR1 (0.76) FGFR1THRBHPGDALDH1A1LMNA
Hydrochloric Acid SCHEMBL7986291 0.91 FGFR1 (0.97) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL121458 0.89 FGFR1 (0.72) FGFR1THRBHPGDALDH1A1LMNA
SCHEMBL24614567 0.88 FGFR1 (0.68) FGFR1THRBHPGDALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113881060-B Friction nanometer power generation material based on manganese-based complex and preparation method and application thereof 中原工学院 2022-09-23 CN claimed
CN-113881060-B Friction nanometer power generation material based on manganese-based complex and preparation method and application thereof 中原工学院 2022-09-23 CN disclosed
CN-113881060-B Friction nanometer power generation material based on manganese-based complex and preparation method and application thereof 中原工学院 2022-09-23 CN disclosed