SCHEMBL15944601

SCHEMBL15944601

CCc1nnc(-c2ccc(C(O)CCl)cc2)o1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.44
NOTUM Q6P988 4/20 0.43
MAPT P10636 2/20 0.41
POLB P06746 2/20 0.41
USP2 O75604 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 3/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
HDAC8 Q9BY41 3/20 0.38
PKM P14618 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
NPC1 O15118 2/20 0.37
MEN1 O00255 2/20 0.37
HTT P42858 2/20 0.37
RAB9A P51151 1/20 0.37
HPGD P15428 1/20 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
SCHEMBL23106548 0.80 NOTUM (0.49) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL14438048 0.76 KMT2A (0.62) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL8050653 0.76 PTGS2 (0.52) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL156353 0.74 KMT2A (0.59) ALDH1A1MAPTPOLBUSP2TSHR
SCHEMBL2388693 0.73 NOTUM (0.54) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL7260633 0.73 NPC1 (0.64) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL13572955 0.73 TSHR (0.73) LMNAMAPTPOLBUSP2TSHR
SCHEMBL8589773 0.73 NPC1 (0.61) ALDH1A1LMNANOTUMMAPTPOLB
SCHEMBL2387073 0.72 SMN1; SMN2 (0.46) ALDH1A1NOTUMMAPTKMT2ASMN1; SMN2
SCHEMBL8235977 0.72 ALDH1A1 (0.67) ALDH1A1LMNANOTUMMAPTPOLB

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-9102643-B2 PDE10 inhibitors and related compositions and methods OMEROS CORPORATION (US) 2015-08-11 US disclosed
US-20140228581-A1 PDE10 INHIBITORS AND RELATED COMPOSITIONS AND METHODS OMEROS CORPORATION (US) 2014-08-14 US disclosed
CN-102869355-A Pde10 inhibitors and related compositions and methods OMEROS CORP 2013-01-09 CN 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-20140228581-A1 PDE10 INHIBITORS AND RELATED COMPOSITIONS AND METHODS PDE10A, PDE9A, PDE7A ALDH1A1 2053/4885LMNA 3928/4885NOTUM 4063/4885

“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.