SCHEMBL32670747

SCHEMBL32670747

FC(F)(F)c1cc(-c2cccc(Br)c2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.58
NOTUM Q6P988 1/20 0.46
IDO1 P14902 1/20 0.46
LOXL2 Q9Y4K0 2/20 0.42
TP53 P04637 1/20 0.42
BIRC5 O15392 1/20 0.41
LOX P28300 1/20 0.41
PTGS2 P35354 2/20 0.40
PTGS1 P23219 1/20 0.40
MAP4K4 O95819 1/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HK1 P19367 1/20 0.39
HKDC1 Q2TB90 1/20 0.39

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
SCHEMBL29581126 0.79 LOXL2 (0.52) SYKNOTUMIDO1LOXL2LOX
SCHEMBL484767 0.79 LOXL2 (0.52) SYKNOTUMIDO1LOXL2LOX
Bromide SCHEMBL15720464 0.77 LOXL2 (0.50) SYKNOTUMIDO1LOXL2LOX
Ammonia Solution, Strong SCHEMBL27910510 0.77 LOXL2 (0.50) SYKNOTUMIDO1LOXL2LOX
SCHEMBL31119651 0.76 KIF11 (0.54) SYKNOTUMIDO1LOXL2LOX
SCHEMBL32670670 0.76 MGLL (0.51) SYKNOTUMIDO1LOXL2LOX
SCHEMBL19347487 0.74 SYK (1.00) SYK
SCHEMBL22322823 0.74 IDO1 (0.56) NOTUMIDO1LOXL2LOXMAP4K4
SCHEMBL18000549 0.74 RAB9A (0.51) SYKIDO1TP53BIRC5RAB9A
SCHEMBL28726693 0.73 SYK (0.46) SYKIDO1TP53RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034105-A1 Generative AI-Assisted Identification of Novel PI3K-alpha Inhibitors THE FIRST AFFILIATED HOSPITAL OF XI'AN JIAOTONG UNIVERSITY (CN) 2026-02-05 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-20260034105-A1 Generative AI-Assisted Identification of Novel PI3K-alpha Inhibitors PIK3R1, PIK3R4, PIK3R2 SYK 695/4885NOTUM 4024/4885IDO1 1199/4885

“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.