SCHEMBL11480901

SCHEMBL11480901

O=C(Nc1ccccc1-n1ccnc1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 2/20 0.60
▸ GAA P10253 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.55
▸ IDH2 P48735 2/20 0.55
▸ NPY5R Q15761 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.53
▸ BRAF P15056 4/20 0.53
▸ LMNA P02545 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ ALOX15 P16050 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ CASP1 P29466 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ CSF1R P07333 1/20 0.51
▸ KCNK3 O14649 1/20 0.50

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
SCHEMBL11463533 0.85 TSHR (0.59) GAAALDH1A1LMNAMEN1KMT2A
SCHEMBL11535043 0.83 IDH2 (0.72) ALDH1A1IDH2BRAFMEN1KMT2A
SCHEMBL11469185 0.83 L3MBTL1 (0.68) LMNAMEN1KMT2AL3MBTL1TSHR
SCHEMBL11472614 0.83 KMT2A (0.60) GAALMNAMEN1KMT2AL3MBTL1
SCHEMBL11471634 0.83 MEN1 (0.70) MEN1KMT2AL3MBTL1KCNK3
SCHEMBL11472439 0.80 KMT2A (0.63) ALDH1A1MEN1KMT2AL3MBTL1TSHR
SCHEMBL7303219 0.79 LMNA (0.66) ALDH1A1LMNAMEN1KMT2AL3MBTL1
SCHEMBL11464516 0.79 MAPT (0.62) GAAALDH1A1LMNAMEN1KMT2A
SCHEMBL11471648 0.79 KMT2A (0.57) ALDH1A1LMNAMEN1KMT2AL3MBTL1
SCHEMBL11480861 0.78 MEN1 (0.57) LMNAMEN1KMT2AL3MBTL1CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4236015-A ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS, FUNGICIDES WESTWOOD PHARMACEUTICALS, INC. (US) 1980-11-25 — — US claimed
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