SCHEMBL2480474

SCHEMBL2480474

CCCC[Sn](CCCC)(CCCC)c1ccccc1CN(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.38
SLC6A2 P23975 10/20 0.38
SLC6A3 Q01959 9/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
TAAR1 Q96RJ0 2/20 0.35
HTR2A P28223 3/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL3848205 0.74 RECQL (0.36) ALDH1A1TSHRTAAR1MEN1KMT2A
SCHEMBL4772254 0.73 L3MBTL1 (0.40) LMNATSHRKDM4ECYP3A4CYP2D6
SCHEMBL11620669 0.72 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL1453183 0.72 TSHR (0.36) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL31558464 0.71 SMN1; SMN2 (0.36) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL7505763 0.71 SMN1; SMN2 (0.36) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL3227093 0.71 CYP1A2 (0.44) ALDH1A1KDM4ECYP3A4CYP2C19HSD17B10
SCHEMBL11202895 0.71 TSHR (0.39) LMNAALDH1A1TSHRKDM4EMEN1
SCHEMBL11624988 0.70 LIPG (0.37) SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL125255 0.70 ALDH1A1 (0.57) SLC6A4SLC6A2SLC6A3LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9024093-B2 Fluorination of organic compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-05-05 US disclosed
US-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2011-12-22 US disclosed
EP-2376408-A2 FLUORINATION OF ORGANIC COMPOUNDS President and Fellows of Harvard College (US) 2011-10-19 EP disclosed
WO-2010059943-A2 FLUORINATION OF ORGANIC COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-05-27 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-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS SLCO1B3, SLCO2B1, FLI1 SLC6A4 1349/4885SLC6A2 2290/4885SLC6A3 1258/4885

“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.