SCHEMBL30383698

SCHEMBL30383698

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

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.82
CTSL P07711 1/20 0.82
CTSB P07858 1/20 0.82
CXCL12 P48061 10/20 0.82
CXCR4 P61073 1/20 0.80
CHRNA7 P36544 1/20 0.73
TUBB4A P04350 1/20 0.73
TUBB P07437 1/20 0.73
TUBA3C P0DPH7 1/20 0.73
TUBA1B P68363 1/20 0.73
TUBA4A P68366 1/20 0.73
TUBB4B P68371 1/20 0.73
TUBB3 Q13509 1/20 0.73
TUBB2A Q13885 1/20 0.73
TUBB8 Q3ZCM7 1/20 0.73
TUBA3E Q6PEY2 1/20 0.73
TUBA1A Q71U36 1/20 0.73
TUBA1C Q9BQE3 1/20 0.73
TUBB6 Q9BUF5 1/20 0.73
TUBB2B Q9BVA1 1/20 0.73

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
SCHEMBL30383354 1.00 CAPN1 (0.82) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL597850 1.00 CAPN1 (0.82) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL597849 1.00 CAPN1 (0.82) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL25198557 0.99 CAPN1 (0.81) CAPN1CTSLCTSBCXCL12CXCR4
Formaldehyde SCHEMBL597329 0.97 CAPN1 (0.79) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL30384490 0.96 CXCL12 (0.89) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL12677857 0.96 CXCL12 (0.89) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL25193952 0.96 CXCL12 (0.89) CAPN1CTSLCTSBCXCL12CXCR4
SCHEMBL5598901 0.91 CXCL12 (0.82) CXCL12CXCR4TUBB4ATUBBTUBA3C
SCHEMBL5598905 0.91 CXCL12 (0.82) CXCL12CXCR4TUBB4ATUBBTUBA3C

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