SCHEMBL13838151

SCHEMBL13838151

Cc1nc(-c2cccc(C(=O)N3CCN(c4nccc(-c5ccccc5)n4)CC3)c2)no1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 6/20 0.58
KDM4E B2RXH2 2/20 0.50
HCAR2 Q8TDS4 1/20 0.48
ALDH1A1 P00352 2/20 0.47
TSHR P16473 2/20 0.47
MGLL Q99685 2/20 0.47
HPGD P15428 1/20 0.46
RHOA P61586 1/20 0.46
PKM P14618 1/20 0.45
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PIK3CA P42336 1/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL13838156 0.89 SLC6A7 (0.66) SLC6A7KDM4EALDH1A1TSHRHPGD
SCHEMBL2223478 0.86 HDAC4 (0.58) SLC6A7KDM4EHCAR2ALDH1A1TSHR
SCHEMBL13838158 0.81 SLC6A7 (0.55) SLC6A7ALDH1A1TSHRMGLLHPGD
SCHEMBL13838152 0.79 SMN1; SMN2 (0.64) KDM4EALDH1A1TSHRHSD17B10LMNA
SCHEMBL13838154 0.78 ALDH1A1 (0.53) SLC6A7ALDH1A1TSHRMGLLRHOA
SCHEMBL13838148 0.77 RHOA (0.49) SLC6A7KDM4ETSHRMGLLRHOA
SCHEMBL13838153 0.77 KMT2A (0.60) KDM4EALDH1A1TSHRLMNAMAPT
SCHEMBL7076934 0.76 L3MBTL1 (0.54) MGLLRHOALMNA
SCHEMBL13838162 0.76 LMNA (0.62) TSHRMGLLRHOALMNASMN1; SMN2
SCHEMBL13838161 0.76 RHOA (0.47) SLC6A7ALDH1A1MGLLRHOALMNA

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-8981084-B2 Oxadiazole HDAC inhibitors TEMPERO PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-20120289495-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals Inc. 2012-11-15 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 (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-20120289495-A1 COMPOUNDS AND METHODS XDH, CCNY, TOP2B SLC6A7 2515/4885KDM4E 2352/4885HCAR2 3017/4885

“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.