SCHEMBL30939970

SCHEMBL30939970

Cc1nc(O)cc2c1[nH]c1cc(O)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 7/20 0.49
▸ KDM4E B2RXH2 6/20 0.46
▸ ALDH1A1 P00352 6/20 0.46
▸ HPGD P15428 6/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ GLI1 P08151 1/20 0.42
▸ GLI2 P10070 1/20 0.42
▸ HSD17B10 Q99714 5/20 0.42
▸ MAPT P10636 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAOA P21397 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ CASP1 P29466 3/20 0.41
▸ CASP7 P55210 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ CYP2D6 P10635 3/20 0.41
▸ BRCA1 P38398 2/20 0.41

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
SCHEMBL16123492 1.00 DYRK1A (0.49) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL16123486 0.84 KDM4E (0.47) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL10708983 0.82 MAPT (0.59) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL16102894 0.82 DYRK1A (0.74) DYRK1AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL16123491 0.82 DYRK1A (0.55) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL30939881 0.82 DYRK1A (0.74) DYRK1AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL647613 0.82 DYRK1A (0.55) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL8852559 0.80 DYRK1A (0.53) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL646288 0.78 DYRK1A (0.51) DYRK1AKDM4EALDH1A1HPGDGLA
SCHEMBL177685 0.77 CCNB2 (0.68) DYRK1AKDM4EALDH1A1HPGDHSD17B10

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
CN-113416187-B Alkylamine harmine derivatives for promoting bone growth 奥斯菲治疗有限公司 2024-07-19 — — CN disclosed
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