SCHEMBL24701231

SCHEMBL24701231

CCC(C)(C)c1nc(-c2ccccc2)c2oc3cc(CC(C)(C)c4nc(-c5cccc(-c6ccccc6)c5)c5oc6ccccc6c5n4)ccc3c2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.37
▸ KMT2A Q03164 6/20 0.37
▸ TSHR P16473 4/20 0.37
▸ HTT P42858 3/20 0.37
▸ LMNA P02545 3/20 0.37
▸ POLB P06746 2/20 0.37
▸ ALDH1A1 P00352 7/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ NPSR1 Q6W5P4 3/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ ATM Q13315 1/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ ALOX12 P18054 1/20 0.33

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
SCHEMBL24474776 0.94 MAPT (0.36) MAPTKMT2ATSHRHTTLMNA
SCHEMBL23874810 0.85 MAPT (0.45) MAPTKMT2ATSHRHTTLMNA
SCHEMBL23473689 0.81 TSHR (0.43) MAPTKMT2ATSHRHTTLMNA
SCHEMBL24700746 0.80 TNKS (0.33) MAPTKMT2ATSHRHTTLMNA
SCHEMBL23874685 0.78 MAPT (0.31) MAPTKMT2ATSHRHTTLMNA
SCHEMBL19162671 0.75 MAPT (0.47) MAPTKMT2ATSHRHTTLMNA
SCHEMBL19161618 0.75 MAPT (0.49) MAPTKMT2ATSHRHTTLMNA
SCHEMBL23920735 0.75 PIM1 (0.39) MAPTKMT2ATSHRHTTLMNA
SCHEMBL24474613 0.74 TNKS (0.32) MAPTKMT2ATSHRHTTLMNA
SCHEMBL24245609 0.74 ALDH1A1 (0.35) KMT2ALMNAPOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220356193-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-11-10 — — 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-20220356193-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME PIEZO1, SOD1, NECTIN4 MAPT 3004/4885KMT2A 2239/4885TSHR 4813/4885

“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.

Send feedback