SCHEMBL19224644

SCHEMBL19224644

COC(=O)c1nc(F)c(C)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.45
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 8/20 0.38
HPGD P15428 4/20 0.38
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 3/20 0.37
MEN1 O00255 2/20 0.37
GAA P10253 2/20 0.37
HSD17B10 Q99714 2/20 0.35
TSHR P16473 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
NPC1 O15118 2/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
TNF P01375 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
SCHEMBL13819563 0.80 ALDH1A1 (0.47) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL19224646 0.75 ALDH1A1 (0.41) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL20907534 0.72 ALDH1A1 (0.41) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL18136486 0.69 ALOX5 (0.61) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL12894510 0.69 ALDH1A1 (0.45) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL19224643 0.69 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPTKMT2A
SCHEMBL130301 0.68 MAPK1 (0.44) ALDH1A1KDM4EKMT2AMEN1PKM
SCHEMBL7453197 0.65 SMN1; SMN2 (0.43) ALDH1A1NPSR1MAPTKMT2ALMNA
SCHEMBL20832544 0.65 ALDH1A1 (0.67) ALDH1A1NPSR1KDM4EHPGDMAPT
SCHEMBL25219141 0.65 MAPT (0.64) ALDH1A1NPSR1KDM4EHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230043400-A1 Compounds, Compositions and Methods DENALI THERAPEUTICS INC. (US) 2023-02-09 US disclosed
US-20200317691-A1 Compounds, Compositions and Methods DENALI THERAPEUTICS INC. (US) 2020-10-08 US disclosed
US-20190112318-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2019-04-18 US disclosed
US-20180099981-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2018-04-12 US disclosed
US-20180099981-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2018-04-12 US disclosed
US-9896458-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2018-02-20 US disclosed
US-9896458-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2018-02-20 US disclosed
US-20180022759-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2018-01-25 US disclosed
US-20180022759-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2018-01-25 US disclosed
US-9815850-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2017-11-14 US disclosed
US-9815850-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2017-11-14 US disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed
US-20170226127-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2017-08-10 US disclosed
US-20170226127-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. 2017-08-10 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 (6 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-20180099981-A1 COMPOUNDS, COMPOSITIONS AND METHODS PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885
US-20200317691-A1 Compounds, Compositions and Methods PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885
US-20230043400-A1 Compounds, Compositions and Methods PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885
US-20180022759-A1 COMPOUNDS, COMPOSITIONS AND METHODS PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885
US-20170226127-A1 COMPOUNDS, COMPOSITIONS AND METHODS PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885
US-20190112318-A1 COMPOUNDS, COMPOSITIONS AND METHODS PIK3CA, PLK1, PIK3CB ALDH1A1 4405/4885NPSR1 4297/4885KDM4E 1466/4885

“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.