SCHEMBL18181908

SCHEMBL18181908

CS(=O)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 1.00
RECQL P46063 1/20 1.00
ALDH1A1 P00352 6/20 0.65
KDM4E B2RXH2 3/20 0.63
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.56
CYP2D6 P10635 1/20 0.56
POLB P06746 1/20 0.53
ACHE P22303 2/20 0.53
TSHR P16473 1/20 0.53
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
HTR2A P28223 1/20 0.52

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
SCHEMBL18177839 0.85 SMN1; SMN2 (0.74) SMN1; SMN2RECQLALDH1A1KDM4EKMT2A
SCHEMBL1029651 0.85 RECQL (0.73) SMN1; SMN2RECQLALDH1A1KDM4EKMT2A
SCHEMBL21164685 0.85 SMN1; SMN2 (0.73) SMN1; SMN2RECQLALDH1A1KDM4EKMT2A
SCHEMBL3709310 0.83 RECQL (0.70) SMN1; SMN2RECQLALDH1A1KDM4EACHE
SCHEMBL24163317 0.82 RECQL (0.69) SMN1; SMN2RECQLALDH1A1KDM4EKMT2A
Hydrochloric Acid SCHEMBL3706762 0.82 RECQL (0.68) SMN1; SMN2RECQLALDH1A1KDM4EACHE
SCHEMBL3956954 0.81 MC4R (0.69) SMN1; SMN2RECQLALDH1A1KDM4EACHE
SCHEMBL3961457 0.80 SMN1; SMN2 (0.66) SMN1; SMN2RECQLALDH1A1KDM4EKMT2A
SCHEMBL25968011 0.80 ACHE (0.73) SMN1; SMN2RECQLALDH1A1KDM4EPOLB
SCHEMBL3285312 0.79 DRD2 (0.65) SMN1; SMN2RECQLALDH1A1ACHETSHR

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-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage WASE, NISHIKANT 2020-03-05 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 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-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 SMN1; SMN2 4517/4885RECQL 2066/4885ALDH1A1 1121/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 SMN1; SMN2 4517/4885RECQL 2066/4885ALDH1A1 1121/4885

“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.