SCHEMBL6071398

SCHEMBL6071398

O=C(NCc1ccco1)c1ccc2[nH]c3c(ccc4cn[nH]c43)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
HPGD P15428 5/20 0.53
TSHR P16473 2/20 0.53
NPC1 O15118 1/20 0.53
TP53 P04637 1/20 0.53
RAB9A P51151 1/20 0.53
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
ALDH1A1 P00352 7/20 0.49
ATM Q13315 1/20 0.48
TLR8 Q9NR97 1/20 0.47
TLR7 Q9NYK1 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KDM4E B2RXH2 2/20 0.45
POLB P06746 3/20 0.45
TDP1 Q9NUW8 1/20 0.45
PKM P14618 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL6070896 0.93 MAPT (0.54) MAPTHPGDTSHRNPC1TP53
SCHEMBL6070463 0.84 IMPDH2 (0.54) MAPTHPGDALDH1A1KDM4E
SCHEMBL5407291 0.81 MAPT (0.64) MAPTHPGDTSHRNPC1TP53
SCHEMBL6070912 0.81 MAPK1 (0.51)
SCHEMBL6070867 0.81 ROCK2 (0.48) MAPTHPGDNPC1POLB
SCHEMBL6071024 0.81 HPGD (0.50) MAPTHPGDCACNA1BAPBA1ALDH1A1
SCHEMBL6071406 0.80 MAOB (0.48) MAPTNPC1TP53RAB9ARXFP1
SCHEMBL6071038 0.79 MAOB (0.39) MAPTHPGDNPC1RAB9AALDH1A1
SCHEMBL6071307 0.79 MAOB (0.41) HPGDNPC1RAB9AALDH1A1TLR8
SCHEMBL6070792 0.78 ROCK2 (0.49) MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2006-11-23 US claimed
US-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2006-11-23 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-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K1, MAP3K19, MAP3K20 MAPT 639/4885HPGD 3207/4885TSHR 2057/4885

“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.