SCHEMBL23930395

SCHEMBL23930395

O=C(O)N1CC(CN(C(=O)OCC2c3ccccc3-c3ccccc32)C2CC2)C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.40
FABP7 O15540 2/20 0.40
KMT2A Q03164 2/20 0.38
OPRD1 P41143 1/20 0.38
EPHX2 P34913 1/20 0.36
CCR5 P51681 4/20 0.34
TSHR P16473 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34
MDM4 O15151 1/20 0.34
TP53 P04637 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CASP3 P42574 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL30267608 0.86 NAMPT (0.41)
SCHEMBL23924702 0.86 NAMPT (0.41)
SCHEMBL25797253 0.85 KMT2A (0.41) FABP5FABP7KMT2AOPRD1EPHX2
SCHEMBL23943193 0.83 FABP5 (0.42) FABP5FABP7KMT2AOPRD1EPHX2
Hydrochloric Acid SCHEMBL23924622 0.82 FABP5 (0.41) FABP5FABP7KMT2AOPRD1EPHX2
Hydrochloric Acid SCHEMBL30020146 0.82 FABP5 (0.41) FABP5FABP7KMT2AOPRD1EPHX2
SCHEMBL11902048 0.80 KMT2A (0.45) FABP5FABP7KMT2AOPRD1EPHX2
SCHEMBL3173765 0.75 KMT2A (0.44) FABP5FABP7KMT2AOPRD1EPHX2
SCHEMBL341372 0.74 KMT2A (0.43) FABP5FABP7KMT2AOPRD1EPHX2
SCHEMBL2039581 0.74 KMT2A (0.42) FABP5FABP7KMT2AOPRD1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4139297-A1 CRYSTALLINE FORMS OF PHTHACAZ1NONF COMPOUND Idience Co., Ltd. (KR) 2023-03-01 EP disclosed
WO-2021214503-A1 CRYSTALLINE FORMS OF PHTHACAZ1NONF COMPOUND IDIENCE CO., LTD. (KR) 2021-10-28 WO disclosed