SCHEMBL30955844

SCHEMBL30955844

C=Cc1ccccc1NC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
TGM2 P21980 1/20 0.42
SNCA P37840 5/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HPGD P15428 2/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
PKM P14618 1/20 0.38
AKT1 P31749 1/20 0.38
EGFR P00533 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38

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
SCHEMBL20877511 1.00 CYP1A2 (0.45) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL9560747 0.85 GPR35 (0.52) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL27664630 0.83 SNCA (0.57) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL11883844 0.82 TGM2 (0.55) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL172214 0.82 CYP2C19 (0.65) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL6694722 0.82 LMNA (0.48) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
Ethylene SCHEMBL7111690 0.79 CYP2C19 (0.61) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL28808749 0.79 CYP2C19 (0.52) CYP1A2CYP2C19POLBMAPTKDM4E
SCHEMBL9779568 0.78 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL26728242 0.78 MAPT (0.65) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19

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
US-20240254093-A1 GPR35 Agonist Compounds NXERA PHARMA UK LIMITED (GB) 2024-08-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240254093-A1 GPR35 Agonist Compounds GPR35, GPR119, GPR68 CYP1A2 1013/4885CYP3A4 2210/4885CYP2D6 2487/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.