SCHEMBL25404330

SCHEMBL25404330

O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1ccc(Oc2ncnc3[nH]ccc23)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 4/20 0.60
▸ KDR P35968 2/20 0.57
▸ BRAF P15056 1/20 0.57
▸ MAPK14 Q16539 1/20 0.57
▸ TNNI3K Q59H18 1/20 0.57
▸ RET P07949 4/20 0.52
▸ KIT P10721 1/20 0.52
▸ TTBK1 Q5TCY1 1/20 0.52
▸ TTBK2 Q6IQ55 1/20 0.52
▸ PDGFRB P09619 1/20 0.51
▸ PDGFRA P16234 1/20 0.51
▸ TRPA1 O75762 2/20 0.51
▸ FLT3 P36888 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ NLRP3 Q96P20 1/20 0.47
▸ JAK2 O60674 1/20 0.47
▸ AKT2 P31751 1/20 0.47

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
SCHEMBL25403334 0.90 KDR (0.65) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL2847973 0.83 KDR (0.74) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL26272089 0.82 KDR (0.66) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL26271759 0.82 CSF1R (0.75) CSF1RKDRBRAFRETPDGFRB
SCHEMBL26272705 0.79 CSF1R (0.63) CSF1RKDRBRAFPDGFRBPDGFRA
SCHEMBL25405250 0.79 CSF1R (0.63) CSF1RKDRBRAFPDGFRBPDGFRA
SCHEMBL25405811 0.77 KDR (0.81) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL29261085 0.77 TRPA1 (0.66) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL4548909 0.76 KDR (0.79) CSF1RKDRBRAFMAPK14TNNI3K
SCHEMBL12975650 0.76 NR2E1 (0.55) CSF1RKDRBRAFMAPK14TNNI3K

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-116789670-A Selective CSF1R inhibitor and application thereof 中国科学院合肥物质科学研究院 2023-09-22 — — CN disclosed
WO-2023173480-A1 SELECTIVE CSF1R INHIBITOR AND USE THEREOF 中国科学院合肥物质科学研究院 2023-09-21 — — WO disclosed
WO-2023173480-A1 SELECTIVE CSF1R INHIBITOR AND USE THEREOF 中国科学院合肥物质科学研究院 2023-09-21 — — WO disclosed
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