SCHEMBL12437747

SCHEMBL12437747

CCn1c2ccccc2c2cc(CN3CCC(Oc4ccc(C(=O)NC5CCN(Cc6ccccc6)CC5)cc4Cl)CC3)ccc21

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.60
TP53 P04637 3/20 0.53
THRB P10828 1/20 0.53
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MCHR1 Q99705 1/20 0.49
DRD4 P21917 1/20 0.49
SLC6A12 P48065 1/20 0.49
SLC6A13 Q9NSD5 1/20 0.49

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
SCHEMBL12437736 0.95 UTS2R (0.61) UTS2RTP53THRBPOLBKMT2A
SCHEMBL12437754 0.93 UTS2R (0.62) UTS2RPOLBKMT2AMEN1DRD4
SCHEMBL12437756 0.89 TP53 (0.59) TP53THRBSMN1; SMN2KMT2AMEN1
SCHEMBL12437772 0.88 UTS2R (0.50) UTS2RTP53THRBPOLBSMN1; SMN2
SCHEMBL12437738 0.88 UTS2R (0.52) UTS2RTP53DRD4
SCHEMBL12437739 0.86 BCHE (0.53) UTS2RTP53POLBSMN1; SMN2KDM4E
SCHEMBL12437803 0.86 UTS2R (0.46) UTS2RTP53THRBSMN1; SMN2KDM4E
SCHEMBL2389013 0.86 UTS2R (0.71) UTS2RKMT2AMEN1MCHR1DRD4
SCHEMBL12437801 0.86 TMEM97 (0.50) UTS2RTP53SMN1; SMN2KMT2AMEN1
SCHEMBL12437702 0.85 MEN1 (0.47) UTS2RTP53KMT2AMEN1DRD4

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-20110178066-A1 Hydroxypiperidine derivatives and uses thereof AVALON PHARMACEUTICALS 2011-07-21 US disclosed
US-20110178066-A1 Hydroxypiperidine derivatives and uses thereof AVALON PHARMACEUTICALS 2011-07-21 US disclosed
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof AVALON PHARMACEUTICALS 2009-02-05 US disclosed
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof AVALON PHARMACEUTICALS 2009-02-05 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-20110178066-A1 Hydroxypiperidine derivatives and uses thereof HPGDS, HPGD, DPYD UTS2R 854/4885TP53 7/4885THRB 3280/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD UTS2R 854/4885TP53 7/4885THRB 3280/4885

“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.