SCHEMBL23747842

SCHEMBL23747842

CC(C)C(CNc1nc(-c2cccs2)nc2ccccc12)N1CCN(C)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 11/20 0.55
KDM4E B2RXH2 7/20 0.55
MAPT P10636 6/20 0.55
LMNA P02545 6/20 0.55
ALDH1A1 P00352 5/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
HTT P42858 4/20 0.55
PDE5A O76074 2/20 0.55
HPGD P15428 2/20 0.53
SLC6A3 Q01959 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 1/20 0.46
PAX8 Q06710 1/20 0.46
KDM1A O60341 1/20 0.46
ACP1 P24666 1/20 0.46
XPO1 O14980 1/20 0.46

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
SCHEMBL23723287 0.83 SLC6A3 (0.54) GBA1PDE5ASLC6A3ACP1
SCHEMBL30125307 0.83 SLC6A3 (0.54) GBA1PDE5ASLC6A3ACP1
SCHEMBL23747909 0.81 PDE5A (0.54) GBA1MAPTLMNAALDH1A1MEN1
SCHEMBL23747843 0.81 SLC6A3 (0.49) GBA1MAPTPDE5ASLC6A3ACP1
SCHEMBL23747914 0.81 SLC6A3 (0.54) GBA1PDE5ASLC6A3ACP1
SCHEMBL30125141 0.81 PDE5A (0.48) KDM4EMAPTMEN1KMT2APDE5A
SCHEMBL23723346 0.81 PDE5A (0.48) KDM4EMAPTMEN1KMT2APDE5A
SCHEMBL23747915 0.80 CYP1A2 (0.57) KDM4EMAPTLMNAALDH1A1MEN1
SCHEMBL23723476 0.80 GBA1 (0.66) GBA1KDM4EMAPTLMNAALDH1A1
SCHEMBL30125338 0.80 GBA1 (0.66) GBA1KDM4EMAPTLMNAALDH1A1

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-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
US-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
US-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
EP-4100395-A1 QUINAZOLINE COMPOUNDS AND THE USE THEREOF IN THE TREATMENT OF CANCER Trobio Therapeutics Pty Ltd (AU) 2022-12-14 EP disclosed
WO-2021155426-A1 QUINAZOLINE COMPOUNDS AND THE USE THEREOF IN THE TREATMENT OF CANCER TroBio Therapeutics Pty Ltd (AU) 2021-08-12 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 (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-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer NQO2, TP53, ABL1 GBA1 1282/4885KDM4E 2051/4885MAPT 3820/4885

“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.