SCHEMBL17809708

SCHEMBL17809708

CCc1ccc(-c2ccc(C(=O)N3CCOCC3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.60
ALDH1A1 P00352 3/20 0.60
MAPT P10636 2/20 0.60
SLC6A7 Q99884 1/20 0.60
LMNA P02545 1/20 0.60
PHGDH O43175 1/20 0.58
HRH3 Q9Y5N1 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.56
KDM4E B2RXH2 1/20 0.55
HTT P42858 1/20 0.55
FKBP1A P62942 1/20 0.55
APC P25054 2/20 0.54
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 1/20 0.53
RAB9A P51151 1/20 0.53
AOC3 Q16853 1/20 0.53

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
SCHEMBL309271 0.95 HPGD (0.64) HPGDALDH1A1MAPTLMNAPHGDH
SCHEMBL14393702 0.83 HPGD (0.61) HPGDALDH1A1MAPTLMNAPHGDH
SCHEMBL17194215 0.83 HPGD (0.63) HPGDALDH1A1MAPTSLC6A7LMNA
SCHEMBL10720943 0.82 PHGDH (0.81) HPGDALDH1A1MAPTPHGDHSMN1; SMN2
SCHEMBL8739521 0.81 HPGD (0.56) HPGDALDH1A1MAPTLMNAHRH3
SCHEMBL8150805 0.81 HPGD (0.76) HPGDALDH1A1MAPTSLC6A7LMNA
SCHEMBL16057730 0.81 PHGDH (0.65) HPGDALDH1A1MAPTLMNAPHGDH
SCHEMBL2786906 0.81 HPGD (0.73) HPGDALDH1A1MAPTPHGDHHRH3
SCHEMBL10264405 0.80 ALDH1A1 (0.62) HPGDALDH1A1MAPTSLC6A7LMNA
SCHEMBL300831 0.80 HPGD (0.68) HPGDALDH1A1MAPTSLC6A7LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-06-09 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-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 HPGD 1938/4885ALDH1A1 1727/4885MAPT 3833/4885

“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.