SCHEMBL2408767

SCHEMBL2408767

CCOc1cc(CCl)ccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
TSHR P16473 2/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
PKM P14618 1/20 0.40
TTR P02766 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CALM1 P0DP23 1/20 0.38
NPSR1 Q6W5P4 3/20 0.38
SLC6A4 P31645 1/20 0.38
THRB P10828 1/20 0.38
MAPT P10636 3/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL16658437 0.85 MAPT (0.47) LMNATSHRHTTKMT2AMEN1
SCHEMBL2505581 0.84 SMN1; SMN2 (0.43) TSHRTTRSLC6A4THRBSMN1; SMN2
SCHEMBL28620316 0.83 LMNA (0.41) LMNATSHRHTTKMT2AMEN1
SCHEMBL2022558 0.82 CALM1 (0.49) LMNATSHRHTTKMT2AMEN1
SCHEMBL31511767 0.82 SLC6A4 (0.42) KMT2AMEN1TTRSLC6A4MAPT
SCHEMBL2406614 0.81 HTT (0.47) LMNATSHRHTTKMT2AMEN1
SCHEMBL3657921 0.81 TTR (0.53) TSHRKMT2AMEN1TTRMAPT
SCHEMBL2406028 0.81 SLC6A4 (0.57) TTRSLC6A4
SCHEMBL28612540 0.79 LMNA (0.48) LMNATSHRHTTTTRCALM1
SCHEMBL3708575 0.79 S1PR1 (0.46) LMNATSHRHTTKMT2AMEN1

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-20110212950-A1 4,4-DISUBSTITUTED PIPERIDINES NOVARTIS AG (CH) 2011-09-01 US disclosed
EP-2212317-A1 4,4-DISUBSTITUTED PIPERIDINES Novartis AG (CH) 2010-08-04 EP disclosed
WO-2009053452-A1 4,4-DISUBSTITUTED PIPERIDINES NOVARTIS AG (CH) 2009-04-30 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-20110212950-A1 4,4-DISUBSTITUTED PIPERIDINES REN, AGTR2, AVPR2 LMNA 3156/4885TSHR 2279/4885HTT 3963/4885

“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.