SCHEMBL16624239

SCHEMBL16624239

CC(=O)c1ccc(I)cc1OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.61
MAPT P10636 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MCL1 Q07820 1/20 0.48
BRD4 O60885 1/20 0.48
FFAR1 O14842 1/20 0.47
SGMS2 Q8NHU3 1/20 0.47
FOLH1 Q04609 1/20 0.46
APP P05067 2/20 0.45
MAOA P21397 2/20 0.45

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
SCHEMBL1316057 0.88 MCL1 (0.56) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL1318328 0.86 FFAR4 (0.54) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL384341 0.85 MAOB (0.78) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL11278414 0.85 MAOB (0.68) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL29369517 0.85 MAOB (0.78) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL7910931 0.84 HTT (0.53) MAOBSMN1; SMN2TDP1L3MBTL1MEN1
SCHEMBL6450060 0.84 MAPT (0.63) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL1041517 0.82 MAOB (0.61) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL1106947 0.82 MAOB (0.61) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL18066348 0.82 MAOB (0.61) MAOBMAPTCYP2C9CYP2C19SMN1; SMN2

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-9751878-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-05 US disclosed
US-20160237087-A1 HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-18 US disclosed
US-9353108-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-05-31 US disclosed
US-20150099777-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-09 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 (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-20150099777-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR4, SSTR2 MAOB 1760/4885MAPT 3648/4885CYP2C9 3183/4885
US-20160237087-A1 HETEROCYCLIC COMPOUNDS SSTR5, SSTR4, SSTR2 MAOB 1610/4885MAPT 3598/4885CYP2C9 3060/4885

“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.