SCHEMBL24006649

SCHEMBL24006649

c1c(C2CCC2)noc1COC1CCCCO1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 7/20 0.34
RAB9A P51151 6/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
IGF1R P08069 3/20 0.32
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
POLB P06746 1/20 0.31
CHRM1 P11229 1/20 0.30
CCR5 P51681 1/20 0.30

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
SCHEMBL24006607 0.80 KDM4C (0.41) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL22275457 0.80 KDM4C (0.41) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL22275507 0.80 KDM4C (0.41) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL24006643 0.78 KDM4C (0.40) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL6041327 0.78 RAB9A (0.52) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL24015128 0.77 KDM4C (0.42) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL7476046 0.77 KMT2A (0.45) NPC1RAB9AMEN1KMT2AICAM1
SCHEMBL15919565 0.77 NAAA (0.40) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL25108415 0.76 KDM4C (0.39) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL25108309 0.76 KDM4C (0.39) KDM4CL3MBTL1NPC1RAB9AMEN1

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-11542278-B1 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-01-03 US disclosed
WO-2021226208-A2 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT, INC. (US) 2021-11-11 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-11542278-B1 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, CYP3A43 KDM4C 1272/4885L3MBTL1 4110/4885NPC1 319/4885

“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.