SCHEMBL6256256

SCHEMBL6256256

CCc1c(C(=O)N2CCN(C(=O)c3cccc(Br)c3)C(C)C2)cnn1-c1nc(-c2ccc(Cl)cc2)cs1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
IDH1 O75874 8/20 0.42
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41
ITGAL P20701 1/20 0.41
SPR P35270 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
EIF4A3 P38919 4/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GHSR Q92847 2/20 0.39

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
SCHEMBL6251735 0.90 PTGER4 (0.43) LMNAMAPTMAPK1SMN1; SMN2IDH1
SCHEMBL6249260 0.83 MEN1 (0.42) LMNAMAPTMAPK1SMN1; SMN2IDH1
SCHEMBL6249552 0.82 NPC1 (0.41) LMNAMAPTMAPK1SMN1; SMN2IDH1
SCHEMBL6255097 0.81 ALDH1A1 (0.51) LMNAMAPTMAPK1SMN1; SMN2MEN1
SCHEMBL6251676 0.77 RAB9A (0.46) LMNAMAPTMAPK1SMN1; SMN2ITGB2
SCHEMBL6225996 0.75 ALDH1A1 (0.46) LMNAMAPTMAPK1SMN1; SMN2ITGB2
SCHEMBL6337679 0.68 MAPT (0.44) LMNAMAPTMAPK1SMN1; SMN2TSHR
SCHEMBL6255491 0.65 KDM4E (0.59) MAPTSMN1; SMN2ITGB2ICAM1ITGAL
SCHEMBL6331924 0.64 KDM4E (0.58) LMNAMAPTSMN1; SMN2ITGB2ICAM1
SCHEMBL3889485 0.63 ALDH1A1 (0.60) TSHRNPSR1HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900219-B2 ABCA-1 elevating compounds CV THERAPEUTICS, INC. (US) 2005-05-31 US disclosed
EP-1513534-A2 COMPOUNDS FOR INCREASING ABCA-1 EXPRESSION USEFUL FOR TREATING CORONARY ARTERY DISEASE AND ATHEROSCLEROSIS CV THERAPEUTICS, INC. (US) 2005-03-16 EP disclosed
US-20030220356-A1 ABCA-1 elevating compounds CV THERAPEUTICS, INC. 2003-11-27 US disclosed
WO-2003084544-A2 COMPOUNDS DOR INCREASING ABCA-1 EXPRESSION USEFUL FOR TREATING CORONARY ARTERY DISEASE AND ATHEROSCLEROSIS CV THERAPEUTICS, INC. (US) 2003-10-16 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-20030220356-A1 ABCA-1 elevating compounds ABCD3, ABCE1, ABCB4 LMNA 1603/4885MAPT 4100/4885MAPK1 2892/4885

“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.