SCHEMBL5999601

SCHEMBL5999601

CNc1cc2c(cc1F)C(=O)N(c1ccc([N+](=O)[O-])c(C)c1)CO2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.40
MAPT P10636 9/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 6/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 3/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
GFER P55789 1/20 0.35
MCL1 Q07820 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RAB9A P51151 2/20 0.33
F10 P00742 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL5508145 0.90 HPGD (0.47) HPGDMAPTKMT2AALDH1A1POLB
SCHEMBL5509910 0.86 MAPT (0.36) HPGDMAPTKMT2AALDH1A1CYP1A2
SCHEMBL14522043 0.84 F10 (0.33) F10
SCHEMBL14522062 0.84 FAAH (0.37) HPGDMAPTKMT2AALDH1A1CYP1A2
SCHEMBL12768203 0.82 TSHR (0.38) ALDH1A1CYP1A2LMNAPKMRAB9A
SCHEMBL5511797 0.80 MAPK14 (0.34) ALDH1A1RAB9AF10NPC1
SCHEMBL12768201 0.77 ALDH1A1 (0.32) ALDH1A1LMNAF10
SCHEMBL5513585 0.75 KMT2A (0.40) MAPTKMT2AALDH1A1CYP2C9CYP2C19
SCHEMBL5508565 0.75 ALOX5AP (0.34)
SCHEMBL14522065 0.75 MAP2K2 (0.33) ALDH1A1LMNAKDM4EF10

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
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
US-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2006-03-30 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-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones TBXAS1, TBXA2R, SERPINC1 HPGD 216/4885MAPT 4809/4885KMT2A 2169/4885

“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.