SCHEMBL6451283

SCHEMBL6451283

Oc1ccc(Br)cc1-c1cc(-c2ncccc2C(F)(F)F)on1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
HPGD P15428 5/20 0.38
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
MEN1 O00255 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
CYP1A2 P05177 4/20 0.38
CYP2C9 P11712 4/20 0.38
CYP2C19 P33261 4/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
MAPT P10636 5/20 0.37
HTT P42858 1/20 0.37
GFER P55789 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TSHR P16473 1/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2D6 P10635 3/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL6449833 0.84 CYP19A1 (0.46) KMT2AHPGDNPC1RAB9AMEN1
SCHEMBL6452179 0.82 KMT2A (0.50) KMT2AHPGDNPC1RAB9AMEN1
SCHEMBL6454145 0.80 CHUK (0.41) KMT2AHPGDNPC1RAB9AMEN1
SCHEMBL6451054 0.77 MAPT (0.53) KMT2AHPGDNPC1RAB9AMEN1
SCHEMBL6450068 0.72 GRK6 (0.42) KMT2AHPGDMEN1SMN1; SMN2MAPT
SCHEMBL6449993 0.70 EPHX2 (0.36) KMT2AHPGDMEN1SMN1; SMN2MAPT
SCHEMBL6449822 0.70 KDM4E (0.38) KMT2AHPGDMEN1MAPTGFER
SCHEMBL6450663 0.69 HSP90AA1 (0.38) KMT2AMEN1NPSR1KDM4ETRPV1
SCHEMBL6449123 0.67 PTPN1 (0.49) KMT2AHPGDNPC1RAB9AMEN1
SCHEMBL6450284 0.66 EPHX2 (0.36) KMT2ANPC1RAB9AMEN1NPSR1

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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 WO 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC KMT2A 3600/4885HPGD 258/4885NPC1 59/4885

“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.