SCHEMBL15540729

SCHEMBL15540729

CC1=CC(N2C(=O)c3ccccc3C2=O)CCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.51
GRM5 P41594 1/20 0.51
ALDH1A1 P00352 5/20 0.44
DDB1 Q16531 3/20 0.44
CRBN Q96SW2 3/20 0.44
IKZF3 Q9UKT9 2/20 0.44
CHRM2 P08172 1/20 0.44
OPRM1 P35372 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
MC4R P32245 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TNF P01375 1/20 0.37
IL1B P01584 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
SCHEMBL16544594 0.92 CYP1A2 (0.46) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL10413063 0.74 CYP1A2 (0.43) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL16140772 0.70 CRBN (0.56) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL1723150 0.69 CYP1A2 (0.47) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL30449036 0.69 ALDH1A1 (0.42) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL1571637 0.69 ALDH1A1 (0.42) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL250230 0.69 ALDH1A1 (0.42) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL16422618 0.69 TSHR (0.43) CYP1A2GRM5ALDH1A1DDB1CRBN
SCHEMBL13735946 0.69 L3MBTL1 (0.46) CYP1A2ALDH1A1DDB1CRBNIKZF3
SCHEMBL18935574 0.69 ALDH1A1 (0.62) CYP1A2ALDH1A1DDB1CRBNIKZF3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2867227-B1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2018-11-21 EP disclosed
US-9487483-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-11-08 US disclosed
US-9487483-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-11-08 US disclosed
US-9487483-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-11-08 US disclosed
US-20150148349-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-28 US disclosed
US-20150148349-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-28 US disclosed
US-20150148349-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2015-05-28 US disclosed
EP-2867227-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF Novartis AG (CH) 2015-05-06 EP disclosed
WO-2014002058-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2014-01-03 WO disclosed
WO-2014002058-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2014-01-03 WO 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-20150148349-A1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF C5, C3AR1, C9 CYP1A2 671/4885GRM5 689/4885ALDH1A1 2392/4885

“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.