SCHEMBL6495987

SCHEMBL6495987

Cc1cc(COc2ncccc2C(=O)O)cc2c1nc(C)n2Cc1ccc(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
PKM P14618 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPSR1 Q6W5P4 1/20 0.39
FABP3 P05413 1/20 0.39
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39
P2RX3 P56373 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCL1 Q07820 1/20 0.37
BAK1 Q16611 1/20 0.37

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
SCHEMBL6488551 0.91 PIK3C2B (0.39) PIK3C2BMCL1BAK1
SCHEMBL6491685 0.88 FABP3 (0.46) PIK3C2BFABP3FABP4FABP5MRGPRX4
SCHEMBL7200058 0.87 FABP3 (0.48) PIK3C2BFABP3FABP4FABP5MRGPRX4
SCHEMBL6498704 0.82 P2RX3 (0.45) P2RX3MRGPRX4LMNASMN1; SMN2PTGER1
SCHEMBL6489657 0.82 KDM4C (0.42) P2RX3MRGPRX4ALOX5APPPARGSLC16A3
SCHEMBL6501562 0.82 NR4A2 (0.57) MRGPRX4NPC1ALOX5APPPARG
SCHEMBL6491233 0.81 MRGPRX4 (0.40) MEN1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL6500552 0.80 MRGPRX4 (0.49) PIK3C2BFABP3FABP4FABP5MRGPRX4
SCHEMBL6493027 0.80 MCL1 (0.43) PIK3C2BMRGPRX4MCL1
SCHEMBL6491218 0.79 CD38 (0.44) PIK3C2BCYP1A2CYP2D6CYP2C9L3MBTL1

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-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD PIK3C2B 2433/4885MEN1 1604/4885KMT2A 561/4885

“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.