SCHEMBL24429262

SCHEMBL24429262

O=C(NCCC1CCCCCCC1)c1ccc(CCCc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.60
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
ACHE P22303 1/20 0.57
MLYCD O95822 2/20 0.54
HDAC8 Q9BY41 1/20 0.54
HSP90AA1 P07900 1/20 0.53
EPHX2 P34913 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL24429320 0.91 LDLR (0.53) CHRM4NPC1RAB9AACHEMLYCD
SCHEMBL8395193 0.86 SMN1; SMN2 (0.68) NPC1RAB9AACHEEPHX2SMN1; SMN2
SCHEMBL8396478 0.86 SMN1; SMN2 (0.68) NPC1RAB9AACHEEPHX2SMN1; SMN2
SCHEMBL8393679 0.85 ACHE (0.66) NPC1RAB9AACHEEPHX2SMN1; SMN2
SCHEMBL10724023 0.85 LDLR (0.62) NPC1RAB9AACHEMLYCDSMN1; SMN2
SCHEMBL17117316 0.83 EPHX1 (0.69) NPC1RAB9AEPHX2SMN1; SMN2
SCHEMBL22919723 0.82 CXCR4 (0.61) NPC1RAB9AACHEMLYCDSMN1; SMN2
SCHEMBL8391438 0.82 ACHE (0.66) CHRM4NPC1RAB9AACHESMN1; SMN2
SCHEMBL8391413 0.81 SMN1; SMN2 (0.64) NPC1RAB9AACHEHDAC8EPHX2
SCHEMBL8393231 0.81 SMN1; SMN2 (0.64) NPC1RAB9AACHEHDAC8EPHX2

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-20220153722-A1 CDK2/5 DEGRADERS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-05-19 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-20220153722-A1 CDK2/5 DEGRADERS AND USES THEREOF CDK2, CDK5, CDK5R1 CHRM4 4632/4885NPC1 3969/4885RAB9A 2900/4885

“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.