SCHEMBL3453087

SCHEMBL3453087

CC1CC(=O)C(c2c[nH]c3ccccc23)C(=O)C1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.67
GAA P10253 1/20 0.67
MAPT P10636 1/20 0.67
IDO1 P14902 3/20 0.52
LMNA P02545 2/20 0.52
HTR2C P28335 5/20 0.51
HTR2A P28223 3/20 0.51
HTR2B P41595 3/20 0.51
PDE4D Q08499 1/20 0.50
PDE1C Q14123 1/20 0.47
SLC6A4 P31645 1/20 0.47
ADRB2 P07550 1/20 0.46
AR P10275 1/20 0.46
KDM4E B2RXH2 2/20 0.45
BRD4 O60885 1/20 0.45
POLB P06746 1/20 0.45
CREBBP Q92793 1/20 0.45
ATM Q13315 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
SCHEMBL3451303 0.84 ALDH1A1 (0.62) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL3264451 0.83 ALDH1A1 (0.69) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL3453120 0.82 ALDH1A1 (0.59) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL1047831 0.81 ALDH1A1 (0.66) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL3264458 0.81 IDO1 (0.56) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL1050492 0.80 ALDH1A1 (1.00) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL1049215 0.74 MAPT (0.68) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL3262533 0.74 IDO1 (0.51) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL29611992 0.71 IDO1 (0.59) ALDH1A1GAAMAPTIDO1LMNA
SCHEMBL19760706 0.71 IDO1 (0.59) ALDH1A1GAAMAPTIDO1LMNA

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-7820691-B2 Indoloquinoline compounds as calcium channel blockers MEDIPROPHARMA, INC. (US) 2010-10-26 US disclosed
EP-2063891-A2 INDOLOQUINOLINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS Medipropharma, Inc. (US) 2009-06-03 EP disclosed
WO-2008027182-A2 INDOLOQUINOLINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS MEDIPROPHARMA, INC. (US) 2008-03-06 WO disclosed
US-20080051426-A1 Indoloquinoline compounds as calcium channel blockers MEDIPROPHARMA, INC. 2008-02-28 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-20080051426-A1 Indoloquinoline compounds as calcium channel blockers CACNA1B, CACNA1C, CACNA1G ALDH1A1 2903/4885GAA 2729/4885MAPT 911/4885

“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.