SCHEMBL4323919

SCHEMBL4323919

N#CCCN1CCN(c2cc(N3CCN(c4cccc(C(F)(F)F)c4)CC3)c(F)cc2C=NNC(N)=S)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
RECQL P46063 1/20 0.41
MAPT P10636 5/20 0.41
ALDH1A1 P00352 2/20 0.41
HTR1A P08908 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SIGMAR1 Q99720 2/20 0.41
HTT P42858 3/20 0.40

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
SCHEMBL4323917 1.00 LMNA (0.41) LMNASMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL13612282 0.89 LMNA (0.43) LMNASMN1; SMN2RECQLMAPTCYP2D6
SCHEMBL4340048 0.89 ALDH1A1 (0.44) LMNASMN1; SMN2MAPTALDH1A1HTR1A
SCHEMBL4340053 0.89 ALDH1A1 (0.44) LMNASMN1; SMN2MAPTALDH1A1HTR1A
SCHEMBL13887193 0.89 DRD2 (0.41) LMNASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL4323994 0.87 NPSR1 (0.50) LMNASMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL4323991 0.87 NPSR1 (0.50) LMNASMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL4334434 0.87 LMNA (0.46) LMNASMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL4334437 0.87 LMNA (0.46) LMNASMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL4331981 0.86 LMNA (0.48) LMNASMN1; SMN2RECQLMAPTALDH1A1

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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-11-19 US disclosed
US-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 US disclosed
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2005-03-31 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 LMNA 4884/4885SMN1; SMN2 4740/4885RECQL 3624/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 LMNA 4885/4885SMN1; SMN2 4815/4885RECQL 3975/4885

“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.