SCHEMBL22258549

SCHEMBL22258549

C=C(Nc1cccnc1)c1n[nH]cc1NCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.47
▸ NOTUM Q6P988 1/20 0.43
▸ NAMPT P43490 2/20 0.42
▸ BCL6 P41182 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ KDM6B O15054 1/20 0.41
▸ KDM4A O75164 1/20 0.41
▸ KDM4D Q6B0I6 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ TSHR P16473 1/20 0.41

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
SCHEMBL22258552 0.94 LTA4H (0.48) LTA4HKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL22258560 0.87 RAB9A (0.42) NAMPTKDM4EMEN1KMT2ARAB9A
SCHEMBL22236099 0.86 NAMPT (0.53) LTA4HNOTUMNAMPTKDM4EKDM6B
SCHEMBL22258490 0.85 SMN1; SMN2 (0.40) NOTUMRAB9ASMN1; SMN2CYP19A1
SCHEMBL22258496 0.83 CYP11B1 (0.36) KDM4ERAB9ASMN1; SMN2CYP19A1NPC1
SCHEMBL22258491 0.83 RAB9A (0.37) NAMPTKDM4EKDM6BKDM4AKDM4D
SCHEMBL22258475 0.81 NPC1 (0.49) MEN1KMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL22235674 0.80 KDR (0.51) LTA4HNAMPTSMN1; SMN2LMNASGMS2
SCHEMBL22258448 0.80 LMNA (0.46) NOTUMNAMPTKMT2ARAB9ASMN1; SMN2
SCHEMBL22258534 0.80 LMNA (0.40) NOTUMNAMPTKDM4ERAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020150545-A1 PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY SAMUMED, LLC (US) 2020-07-23 — — WO disclosed
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