SCHEMBL6840741

SCHEMBL6840741

NCc1cccc([C@]2(C(=O)Nc3ccc(N4CCCCC4=O)cc3)CCC(=O)N2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
PKM P14618 1/20 0.43
F10 P00742 7/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
MAPT P10636 2/20 0.41
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
NAMPT P43490 1/20 0.39
CDK2 P24941 1/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL6840749 1.00 LMNA (0.44) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL6840564 0.88 LMNA (0.45) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL6840565 0.88 LMNA (0.45) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL6839757 0.88 LMNA (0.44) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL6840596 0.85 LMNA (0.46) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL5164898 0.76 SMN1; SMN2 (0.52) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL6842237 0.75 F10 (0.41) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL5164789 0.75 TSHR (0.48) LMNATSHRHPGDSMN1; SMN2NPC1
SCHEMBL27585019 0.74 F10 (0.44) LMNATSHRHPGDNPC1RAB9A
SCHEMBL27585029 0.74 F10 (0.44) LMNATSHRHPGDNPC1RAB9A

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-20040082563-A1 Phenyl derivatives 3 MERCK PATENT GMBH (DE) 2004-04-29 US claimed
US-20040082563-A1 Phenyl derivatives 3 MERCK PATENT GMBH (DE) 2004-04-29 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 (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-20040082563-A1 Phenyl derivatives 3 F2, F11, F12 LMNA 910/4885TSHR 484/4885HPGD 672/4885

“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.