SCHEMBL3022079

SCHEMBL3022079

CCCn1c(NCc2ccccc2O)nc2ccccc21

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.86
ALDH1A1 P00352 7/20 0.86
MAPK1 P28482 2/20 0.86
HPGD P15428 1/20 0.86
MEN1 O00255 3/20 0.77
KMT2A Q03164 3/20 0.77
POLB P06746 2/20 0.77
SMN1; SMN2 Q16637 4/20 0.74
NPC1 O15118 1/20 0.74
RAB9A P51151 1/20 0.74
TP53 P04637 3/20 0.73
PKM P14618 3/20 0.70
GAA P10253 3/20 0.70
TSHR P16473 2/20 0.70
ALOX15 P16050 2/20 0.69
HTT P42858 3/20 0.69
NPSR1 Q6W5P4 2/20 0.69
USP2 O75604 1/20 0.69
ATM Q13315 1/20 0.69
HSD17B10 Q99714 1/20 0.65

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
SCHEMBL20715589 0.90 MAPT (0.91) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3024327 0.90 ALDH1A1 (0.77) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3022255 0.87 MAPT (1.00) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3024216 0.87 ALDH1A1 (0.73) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3028381 0.86 MAPT (0.88) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL20715322 0.85 SMN1; SMN2 (0.81) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL13166612 0.84 MAPT (0.85) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3024150 0.84 MEN1 (0.79) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL3029198 0.82 MAPT (1.00) MAPTALDH1A1MAPK1HPGDMEN1
SCHEMBL29352287 0.82 MEN1 (1.00) MAPTALDH1A1MAPK1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9316633-B2 Methods for identifying inhibitors of solute transporters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-04-19 US disclosed
US-20100190796-A1 METHODS FOR IDENTIFYING INHIBITORS OF SOLUTE TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-07-29 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-20100190796-A1 METHODS FOR IDENTIFYING INHIBITORS OF SOLUTE TRANSPORTERS SLC2A1, SLC2A3, SLC2A8 MAPT 1849/4885ALDH1A1 3404/4885MAPK1 2433/4885

“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.