SCHEMBL24299072

SCHEMBL24299072

Cc1ccccc1-c1cc(O)n[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.68
ALOX15 P16050 7/20 0.68
MAPT P10636 7/20 0.68
RAB9A P51151 7/20 0.68
SMN1; SMN2 Q16637 6/20 0.68
NFKB1 P19838 5/20 0.68
NFKB2 Q00653 5/20 0.68
RELA Q04206 5/20 0.68
USP2 O75604 3/20 0.68
TSHR P16473 1/20 0.68
MEN1 O00255 9/20 0.62
KMT2A Q03164 9/20 0.62
NPC1 O15118 7/20 0.62
NPSR1 Q6W5P4 3/20 0.62
TP53 P04637 2/20 0.62
LMNA P02545 2/20 0.62
GLA P06280 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
ALDH1A1 P00352 3/20 0.44
POLB P06746 1/20 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
SCHEMBL17280247 0.82 ALOX15 (0.75) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL21262770 0.82 RAB9A (0.60) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL10357589 0.81 SMN1; SMN2 (1.00) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL1407405 0.79 HSD17B10 (0.63) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL17962550 0.79 HPGD (0.57) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL17279997 0.78 RAB9A (0.69) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL9071981 0.77 HSD17B10 (0.69) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL10358110 0.76 MAPT (1.00) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL17279878 0.75 ALOX15 (0.65) HPGDALOX15MAPTRAB9ASMN1; SMN2
SCHEMBL22978372 0.75 TNIK (0.62) HPGDALOX15MAPTRAB9ASMN1; SMN2

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-2023059884-A1 ALDH INHIBITORS TO PROMOTE IMMUNE CELL EXPANSION UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-04-13 WO claimed
WO-2023059884-A1 ALDH INHIBITORS TO PROMOTE IMMUNE CELL EXPANSION UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-04-13 WO disclosed
WO-2022076621-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO disclosed