SCHEMBL13080474

SCHEMBL13080474

CCc1c2ccccc2nn1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MPO P05164 6/20 0.56
MAPK1 P28482 2/20 0.49
ALDH1A1 P00352 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NR4A3 Q92570 1/20 0.47
ESR2 Q92731 1/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
MYC P01106 1/20 0.39
GRM4 Q14833 1/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 1/20 0.38
PDE7A Q13946 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL1921618 0.81 MPO (0.51) MPOMAPK1ALDH1A1L3MBTL1ESR2
SCHEMBL1921110 0.81 CNR2 (0.48) MPOLMNATSHR
SCHEMBL29043091 0.81 CNR2 (0.48) MPOLMNATSHR
SCHEMBL1921321 0.81 MPO (0.50) MPOMAPK1ALDH1A1L3MBTL1ESR2
SCHEMBL1920947 0.80 MPO (0.47) MPOMAPK1ALDH1A1L3MBTL1MYC
SCHEMBL1921546 0.79 MPO (0.49) MPOMAPK1ALDH1A1L3MBTL1NR4A3
SCHEMBL29028700 0.78 MPO (0.47) MPOMAPK1ALDH1A1L3MBTL1ESR2
SCHEMBL1921361 0.78 MPO (0.47) MPOALDH1A1NR4A3ESR2LMNA
SCHEMBL28748703 0.77 MEN1 (0.41) MPOALDH1A1NR4A3ESR2LMNA
SCHEMBL12534013 0.77 MPO (0.47) MPOMAPK1ALDH1A1L3MBTL1NR4A3

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-11011712-B2 Tetradentate cyclometalated platinum complexes containing 9,10-dihydroacridine and its analogues ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2021-05-18 US disclosed
US-9822118-B2 Bicyclic heteroaryl urea, thiourea, guanidine and cyanoguanidine compounds as TrkA kinase inhibitors ARRAY BIOPHARMA INC. (US) 2017-11-21 US disclosed
US-8283476-B2 Transition metal catalyzed synthesis of 2H-indazoles SANOFI (FR) 2012-10-09 US disclosed
US-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles SANOFI-AVENTIS (FR) 2010-09-16 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-11011712-B2 Tetradentate cyclometalated platinum complexes containing 9,10-dihydroacridine and its analogues DPYD, DCTD, TYMP MPO 1730/4885MAPK1 4396/4885ALDH1A1 1020/4885
US-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles H1-3, H1-2, H1-4 MPO 1473/4885MAPK1 3348/4885ALDH1A1 259/4885

“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.