SCHEMBL24801643

SCHEMBL24801643

CNC(=O)c1ccc(F)cc1[C@H]1CCCN1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.47
JAK2 O60674 1/20 0.39
NTRK1 P04629 1/20 0.39
HPGD P15428 1/20 0.38
KCNH2 Q12809 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPK3 P27361 1/20 0.37
MAPK1 P28482 1/20 0.37
BRD4 O60885 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PDE10A Q9Y233 1/20 0.36
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
PARP1 P09874 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36

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
SCHEMBL24233561 0.84 MEN1 (0.43) HPGDKCNH2MEN1KMT2ANPC1
SCHEMBL21835399 0.83 PRKAB2 (0.40) KCNH2MEN1KMT2AL3MBTL1PARP1
SCHEMBL454756 0.83 PRKAB2 (0.40) KCNH2MEN1KMT2AL3MBTL1PARP1
SCHEMBL23323171 0.81 CREBBP (0.51) CREBBPMEN1KMT2ABRD4PARP1
Oxalic Acid SCHEMBL28871384 0.75 HCAR2 (0.40) KCNH2MEN1KMT2APARP1
Oxalic Acid SCHEMBL28871386 0.75 HCAR2 (0.40) KCNH2MEN1KMT2APARP1
SCHEMBL21494179 0.74 HTR2A (0.41) KCNH2MEN1KMT2ACCNT1CDK9
SCHEMBL21494180 0.74 HTR2A (0.41) KCNH2MEN1KMT2ACCNT1CDK9
SCHEMBL22097356 0.74 MEN1 (0.44) KCNH2MEN1KMT2AL3MBTL1CCNT1
SCHEMBL4102503 0.74 MEN1 (0.44) KCNH2MEN1KMT2AL3MBTL1CCNT1

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-20220409731-A1 DEGRADERS THAT TARGET ALK AND THERAPEUTIC USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-12-29 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-20220409731-A1 DEGRADERS THAT TARGET ALK AND THERAPEUTIC USES THEREOF ALK, BCR, FAP CREBBP 1983/4885JAK2 2883/4885NTRK1 135/4885

“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.