SCHEMBL30384286

SCHEMBL30384286

COc1cc(/C=C/C(=O)c2ccc(F)cc2)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 10/20 1.00
CXCR4 P61073 1/20 0.76
RELA Q04206 2/20 0.73
ALDH1A1 P00352 1/20 0.71
KRAS P01116 1/20 0.71
ATM Q13315 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
TUBB4A P04350 1/20 0.70
TUBB P07437 1/20 0.70
TUBA3C P0DPH7 1/20 0.70
TUBA1B P68363 1/20 0.70
TUBA4A P68366 1/20 0.70
TUBB4B P68371 1/20 0.70
TUBB3 Q13509 1/20 0.70
TUBB2A Q13885 1/20 0.70
TUBB8 Q3ZCM7 1/20 0.70
TUBA3E Q6PEY2 1/20 0.70
TUBA1A Q71U36 1/20 0.70
TUBA1C Q9BQE3 1/20 0.70

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
SCHEMBL25201290 1.00 CXCL12 (1.00) CXCL12CXCR4RELAALDH1A1KRAS
SCHEMBL2246091 1.00 CXCL12 (1.00) CXCL12CXCR4RELAALDH1A1KRAS
SCHEMBL2249172 1.00 CXCL12 (1.00) CXCL12CXCR4RELAALDH1A1KRAS
SCHEMBL30383469 1.00 CXCL12 (1.00) CXCL12CXCR4RELAALDH1A1KRAS
Water SCHEMBL25195597 0.99 CXCL12 (0.97) CXCL12CXCR4RELAALDH1A1KRAS
SCHEMBL30384490 0.93 CXCL12 (0.89) CXCL12CXCR4RELATUBB4ATUBB
SCHEMBL25193952 0.93 CXCL12 (0.89) CXCL12CXCR4RELATUBB4ATUBB
SCHEMBL12677857 0.93 CXCL12 (0.89) CXCL12CXCR4RELATUBB4ATUBB
SCHEMBL25199011 0.89 CXCL12 (0.81) CXCL12RELAALDH1A1KRASATM
SCHEMBL25198994 0.89 CXCL12 (0.81) CXCL12RELAALDH1A1KRASATM

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 WO disclosed
EP-4429763-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS Yewsavin, Inc. (US) 2024-09-18 EP disclosed
WO-2023086388-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2023-05-19 WO disclosed