SCHEMBL11564007

SCHEMBL11564007

Cc1cccc(-c2nc3cc(C(=O)O)ccc3o2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 5/20 0.66
NPC1 O15118 6/20 0.61
RAB9A P51151 6/20 0.61
SMN1; SMN2 Q16637 5/20 0.61
KDM4E B2RXH2 5/20 0.61
HPGD P15428 4/20 0.61
ALDH1A1 P00352 4/20 0.61
TP53 P04637 3/20 0.61
HSD17B10 Q99714 2/20 0.61
MAPT P10636 5/20 0.60
POLB P06746 1/20 0.59
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
HDAC6 Q9UBN7 3/20 0.57
NFKB1 P19838 2/20 0.56
NFKB2 Q00653 2/20 0.56
RELA Q04206 2/20 0.56
DUSP1 P28562 2/20 0.54

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
SCHEMBL31261528 0.90 TTR (0.62) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675297 0.90 KDM4E (0.68) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675525 0.89 HDAC6 (0.63) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL445014 0.86 HDAC6 (0.74) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675435 0.85 HPSE (0.62) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675388 0.85 SMN1; SMN2 (0.68) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4886394 0.84 HPSE (0.63) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675296 0.84 ALDH1A1 (0.67) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL1675540 0.83 HDAC6 (0.71) HPSENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL3401206 0.83 RAB9A (0.79) NPC1RAB9ASMN1; SMN2KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024225738-A1 BENZOXAZOLE DERIVATIVE COMPOUND HAVING DUAL AGONISTIC ACTIVITY ON FXR/PPAR ALPHA FOR TREATMENT OR PREVENTION OF FATTY LIVER DISEASE 부산대학교 산학협력단 2024-10-31 WO claimed
WO-2024225738-A1 BENZOXAZOLE DERIVATIVE COMPOUND HAVING DUAL AGONISTIC ACTIVITY ON FXR/PPAR ALPHA FOR TREATMENT OR PREVENTION OF FATTY LIVER DISEASE 부산대학교 산학협력단 2024-10-31 WO disclosed
US-4169837-A BICHROMOPHORIC BENZOXAZOLE ULTRAVIOLET STABILIZERS EASTMAN KODAK COMPANY (US) 1979-10-02 US disclosed
US-4029670-A Polychromophoric heterocyclic ultraviolet stabilizers EASTMAN KODAK COMPANY (US) 1977-06-14 US disclosed