SCHEMBL24241738

SCHEMBL24241738

CCOc1ccc2nc(Sc3ccccc3)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 5/20 0.47
▸ RXFP1 Q9HBX9 5/20 0.47
▸ MAPT P10636 5/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ TSHR P16473 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ NCF1 P14598 1/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ THRB P10828 3/20 0.43

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
SCHEMBL24534750 0.78 KMT2A (0.48) TP53RXFP1MAPTNPC1RAB9A
SCHEMBL28180362 0.75 MAPT (0.55) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL15663471 0.74 KDM4E (0.49) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL11775727 0.73 HPGD (0.49) TP53RXFP1MAPTNPC1RAB9A
Water SCHEMBL30558837 0.73 TLR8 (0.51) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL8361511 0.73 MAPT (0.63) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9694076 0.72 KDM4E (0.54) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL29980222 0.71 HPGD (0.58) TP53RXFP1MAPTNPC1RAB9A
SCHEMBL16200806 0.71 LTA4H (0.61) TP53RXFP1MAPTNPC1RAB9A
SCHEMBL2114821 0.71 HPGD (0.58) TP53RXFP1MAPTNPC1RAB9A

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
EP-3949963-A1 NOVEL COMPOUND AND COMPOSITION FOR PREVENTION OR TREATMENT OF RESPIRATORY DISEASES COMPRISING SAME AS ACTIVE INGREDIENT Yonsei University, University-Industry Foundation(UIF). (KR) 2022-02-09 — — EP disclosed
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