SCHEMBL2970947

SCHEMBL2970947

Clc1ccc(C2=C(CN3CCN(c4cc[c]cc4)CC3)COCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.46
BCL2L1 Q07817 2/20 0.46
DRD4 P21917 3/20 0.41
DRD5 P21918 1/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.38
SLC2A1 P11166 1/20 0.37
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL1540189 0.84 BCL2 (0.48) BCL2BCL2L1DRD4DRD5MAPT
SCHEMBL1540186 0.84 BCL2 (0.48) BCL2BCL2L1DRD4DRD5MAPT
SCHEMBL2959933 0.83 BCL2L1 (0.47) BCL2BCL2L1DRD4DRD5MAPT
SCHEMBL1955370 0.83 BCL2L1 (0.66) BCL2BCL2L1DRD4
SCHEMBL2975749 0.82 BCL2L1 (0.47) BCL2BCL2L1DRD4DRD5MAPT
SCHEMBL1111710 0.78 NPC1 (0.40) BCL2BCL2L1ALDH1A1KDM4EGAA
SCHEMBL2973314 0.76 BCL2L1 (0.60) BCL2BCL2L1DRD4
SCHEMBL27629603 0.74 MAPT (0.67) DRD4DRD5MAPTALDH1A1LMNA
SCHEMBL2968711 0.74 BCL2L1 (0.48) BCL2BCL2L1DRD4DRD5MAPT
SCHEMBL1540934 0.67 BCL2L1 (0.50) BCL2BCL2L1DRD4DRD5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888543-B1 APOPTOSIS PROMOTERS ABBOTT LAB (US) 2012-08-01 EP disclosed
US-7777076-B2 Macrocyclic inhibitors of BCL proteins ABBOTT LABORATORIES (US) 2010-08-17 US disclosed
US-20080194691-A1 Apoptosis Promoters ABBOTT LABORATORIES (US) 2008-08-14 US disclosed
EP-1888543-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2008-02-20 EP disclosed
WO-2006127364-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2006-11-30 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-20080194691-A1 Apoptosis Promoters BAX, BCL2, BCOR BCL2 2/4885BCL2L1 6/4885DRD4 3815/4885

“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.