SCHEMBL21054255

SCHEMBL21054255

Clc1nc(N2CCOCC2)c2cc(-c3ccncc3)sc2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 6/20 0.60
HPGD P15428 3/20 0.60
LMNA P02545 3/20 0.60
MAPK1 P28482 2/20 0.60
HSD17B10 Q99714 2/20 0.60
TSHR P16473 1/20 0.60
PIKFYVE Q9Y2I7 1/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
USP2 O75604 1/20 0.53
HTT P42858 2/20 0.46
GSK3B P49841 3/20 0.45
CDK2 P24941 1/20 0.45
PIK3CA P42336 2/20 0.45
PIK3CB P42338 1/20 0.45
CNR2 P34972 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CNR1 P21554 2/20 0.44
POLB P06746 2/20 0.44

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
SCHEMBL14034101 0.89 ALDH1A1 (0.74) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL21054518 0.83 PIK3CA (0.53) PIKFYVEGSK3BCDK2PIK3CAPIK3CB
SCHEMBL21053855 0.83 PIKFYVE (0.62) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL1862072 0.83 KDM4E (0.54) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL1858593 0.82 KDM4E (0.53) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL4439748 0.82 KDM4E (0.61) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL4438348 0.80 SMN1; SMN2 (0.52) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL4433844 0.80 PIK3CA (0.70) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL4446531 0.79 SMN1; SMN2 (0.51) KDM4EALDH1A1HPGDLMNAMAPK1
SCHEMBL21054789 0.79 KDM4E (0.47) KDM4EALDH1A1HPGDLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11603372-B2 Compounds and therapeutic uses thereof VIOGEN BIOSCIENCES, LLC (US) 2023-03-14 US disclosed
US-20210122752-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VIOGEN BIOSCIENCES, LLC 2021-04-29 US disclosed
US-20210122752-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VIOGEN BIOSCIENCES, LLC 2021-04-29 US disclosed
WO-2019113523-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF BAJJI ASHOK (US) 2019-06-13 WO disclosed
WO-2019113523-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF BAJJI ASHOK (US) 2019-06-13 WO 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-11603372-B2 Compounds and therapeutic uses thereof IL15, IL17A, IL2 KDM4E 3881/4885ALDH1A1 1513/4885HPGD 3886/4885
US-20210122752-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF IL15, IL17A, IL2 KDM4E 3881/4885ALDH1A1 1513/4885HPGD 3886/4885

“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.