SCHEMBL27052011

SCHEMBL27052011

CC(C)c1c(C(F)(F)F)c(Cl)cc2nc(N)sc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
SCN4A P35499 3/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
EPHX2 P34913 1/20 0.36
TP53 P04637 2/20 0.31
CYP3A4 P08684 2/20 0.31
KCNH2 Q12809 1/20 0.31
GMNN O75496 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL27051981 0.84 SMN1; SMN2 (0.40) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27051971 0.84 SMN1; SMN2 (0.46) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27051989 0.84 HSD17B10 (0.44) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27052004 0.84 SMN1; SMN2 (0.46) SMN1; SMN2SCN4ANPC1RAB9ATP53
SCHEMBL27051991 0.81 HSD17B10 (0.43) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27052017 0.78 HSD17B10 (0.47) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27052005 0.77 SMN1; SMN2 (0.41) SMN1; SMN2HSD17B10SCN4ANPC1RAB9A
SCHEMBL27052002 0.76 SMN1; SMN2 (0.40) SMN1; SMN2SCN4ANPC1RAB9ATP53
SCHEMBL27051983 0.75 SMN1; SMN2 (0.41) SMN1; SMN2HSD17B10HPGDSCN4ANPC1
SCHEMBL27052003 0.75 SMN1; SMN2 (0.39) SMN1; SMN2HSD17B10SCN4ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 US disclosed
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 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 (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-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS SMN1; SMN2 3857/4885HSD17B10 3313/4885HPGD 397/4885

“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.