SCHEMBL6500422

SCHEMBL6500422

O=C(CN(c1ccccc1)c1ccccc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 6/20 0.56
CACNA1B Q00975 6/20 0.56
CACNB1 Q02641 6/20 0.56
BCL2 P10415 4/20 0.48
BAK1 Q16611 2/20 0.48
HTR7 P34969 3/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
BCL2L1 Q07817 2/20 0.46
DRD4 P21917 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FAAH O00519 1/20 0.45
MGLL Q99685 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL1958329 0.83 HTR7 (0.55) BCL2BAK1HTR7LMNAPOLB
SCHEMBL1446676 0.81 LMNA (0.53) BCL2BAK1HTR7LMNAPOLB
SCHEMBL1446715 0.79 HTR7 (0.51) BCL2BAK1HTR7LMNAPOLB
SCHEMBL3954643 0.79 CACNA1G (0.55) BCL2BAK1HTR7LMNAPOLB
SCHEMBL588394 0.76 SIGMAR1 (0.67) BCL2BAK1HTR7LMNADRD4
SCHEMBL2116073 0.76 HTR7 (0.53) BCL2BAK1HTR7BCL2L1ALDH1A1
SCHEMBL8744976 0.75 KDM4E (0.55) BCL2BAK1HTR7BCL2L1DRD4
SCHEMBL29137691 0.75 BCL2 (0.57) BCL2BAK1HTR7LMNAPOLB
Hydrochloric Acid SCHEMBL587708 0.75 SIGMAR1 (0.65) BCL2BAK1HTR7LMNADRD4
SCHEMBL1138135 0.75 HTR7 (0.60) BCL2BAK1HTR7LMNABCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050227999-A1 Diarylamine derivatives as calcium channel blockers NEUROMED TECHNOLOGIES INC. 2005-10-13 US claimed

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-20050227999-A1 Diarylamine derivatives as calcium channel blockers ORAI1, CACNA1D, CACNA1C CACNA2D1 51/4885CACNA1B 4/4885CACNB1 12/4885

“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.