SCHEMBL5873071

SCHEMBL5873071

Brc1cccc(-c2csc(-c3n[nH]c4ccccc34)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
MEN1 O00255 7/20 0.50
KMT2A Q03164 7/20 0.50
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 5/20 0.50
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
HPGD P15428 3/20 0.50
GAA P10253 3/20 0.50
HK1 P19367 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
DCLK1 O15075 1/20 0.47
PRKD3 O94806 1/20 0.47
MAP4K4 O95819 1/20 0.47
CHEK2 O96017 1/20 0.47
CSF1R P07333 1/20 0.47
FER P16591 1/20 0.47
CDK2 P24941 1/20 0.47
MARK3 P27448 1/20 0.47

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
SCHEMBL5772080 0.86 KDM4E (0.60) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5767752 0.85 KDM4E (0.51) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5873083 0.82 NPC1 (0.50) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5772763 0.82 CYP19A1 (0.57) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5769985 0.82 MAP2K4 (0.71) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL5776582 0.81 IDO1 (0.67) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5873078 0.81 RAB9A (0.55) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5768166 0.79 IDO1 (0.66) ALDH1A1KDM4ERAB9ANPC1MKNK2
SCHEMBL5771544 0.79 CYP19A1 (0.51) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5777148 0.79 KDM4E (0.63) MAPTMEN1KMT2AALDH1A1KDM4E

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-6984652-B2 Gyrase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2006-01-10 US disclosed
US-20050250823-A1 Gyrase inhibitors YAGER KRAIG 2005-11-10 US disclosed
US-20050054697-A1 Gyrase inhibitors PFIZER INC. 2005-03-10 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 (2 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-20050054697-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B MAPT 3874/4885MEN1 3349/4885KMT2A 3223/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B MAPT 3874/4885MEN1 3349/4885KMT2A 3223/4885

“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.