SCHEMBL24176137

SCHEMBL24176137

CC(C)c1cc(C(F)(F)F)cc2nc(N)sc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 3/20 0.45
EPHX2 P34913 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.41
HSD17B10 Q99714 3/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
MET P08581 1/20 0.35
MAPT P10636 1/20 0.35
TP53 P04637 3/20 0.33
CYP3A4 P08684 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
KCNH2 Q12809 1/20 0.33
GMNN O75496 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
GAA P10253 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
SCHEMBL24175979 0.81 SMN1; SMN2 (0.64) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27051714 0.80 SMN1; SMN2 (0.45) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27264665 0.76 SCN4A (0.49) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27052017 0.73 HSD17B10 (0.47) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27316214 0.72 KCNN4 (0.32) RAB9ANPC1MET
SCHEMBL9805815 0.71 ALDH1A1 (0.51) SCN4AEPHX2HPGDMAPTCYP3A4
SCHEMBL27051971 0.71 SMN1; SMN2 (0.46) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27051989 0.71 HSD17B10 (0.44) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL27051981 0.71 SMN1; SMN2 (0.40) SCN4AEPHX2SMN1; SMN2HSD17B10HPGD
SCHEMBL9861275 0.70 PDE2A (0.36) ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-08-03 US disclosed
US-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-08-03 US disclosed
WO-2022002102-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2022-01-06 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-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS SCN4A 1301/4885EPHX2 3182/4885SMN1; SMN2 4219/4885

“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.