SCHEMBL30384875

SCHEMBL30384875

CN(C)CCN(C)c1cccc(/C=C/C(=O)c2ccc(O)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.56
P4HB P07237 5/20 0.54
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
TLR9 Q9NR96 1/20 0.53
F3 P13726 2/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
CYP1B1 Q16678 2/20 0.52
MEN1 O00255 1/20 0.52
ALDH2 P05091 1/20 0.52
CYP3A4 P08684 1/20 0.52
HSPD1 P10809 1/20 0.52
CYP19A1 P11511 1/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
HSPE1 P61604 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RELA Q04206 1/20 0.50
ACHE P22303 3/20 0.49

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
SCHEMBL25184970 1.00 BCHE (0.56) BCHEP4HBCRHBPCRHR2TLR9
SCHEMBL3691582 1.00 BCHE (0.56) BCHEP4HBCRHBPCRHR2TLR9
SCHEMBL3690207 0.90 BCHE (0.54) BCHEMAPTKMT2ACYP1B1MAOB
SCHEMBL3687867 0.90 BCHE (0.54) BCHEMAPTKMT2ACYP1B1MAOB
SCHEMBL3689808 0.89 MAOB (0.60) BCHEMAPTKMT2ACYP1B1MAOA
SCHEMBL3688869 0.89 MAOB (0.60) BCHEMAPTKMT2ACYP1B1MAOA
SCHEMBL3682843 0.89 P4HB (0.57) BCHEP4HBCYP1B1
SCHEMBL3696162 0.88 BCHE (0.56) BCHEP4HBCRHBPCRHR2TLR9
SCHEMBL3691580 0.88 BCHE (0.56) BCHEP4HBCRHBPCRHR2TLR9
SCHEMBL3695625 0.87 MAOB (0.64) BCHEF3MAPTKMT2ACYP1B1

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