SCHEMBL25122525

SCHEMBL25122525

CCC1CCN(CCOC2CCN(C(C)C)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.45
▸ VCP P55072 1/20 0.40
▸ HRH3 Q9Y5N1 15/20 0.40
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT6 Q96LA8 1/20 0.33

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
SCHEMBL25123392 0.88 NPC1 (0.41) NPC1VCPHRH3
SCHEMBL24233184 0.86 NPC1 (0.46) NPC1VCPHRH3CARM1PRMT6
SCHEMBL22520618 0.85 NPC1 (0.56) NPC1VCPHRH3
SCHEMBL26949128 0.84 NPC1 (0.47) NPC1VCPHRH3CARM1PRMT6
SCHEMBL27013338 0.83 NPC1 (0.50) NPC1VCPHRH3CARM1PRMT6
SCHEMBL26949131 0.83 NPC1 (0.53) NPC1VCPHRH3
SCHEMBL18389833 0.80 NPC1 (0.58) NPC1VCPHRH3
SCHEMBL13741291 0.80 HRH3 (0.51) NPC1VCPHRH3CARM1
SCHEMBL178291 0.78 HRH3 (0.43) HRH3
SCHEMBL24475400 0.77 NPC1 (0.50) NPC1VCPHRH3CARM1PRMT6

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-20240018123-A1 COMPOUND FOR INHIBITING OR DISINTEGRATING ANDROGEN RECEPTOR, AND PHARMACEUTICAL USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2024-01-18 — — US disclosed
US-20230110180-A1 CDK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-13 — — 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 (2 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-20240018123-A1 COMPOUND FOR INHIBITING OR DISINTEGRATING ANDROGEN RECEPTOR, AND PHARMACEUTICAL USE THEREOF AR, NR5A1, SHBG NPC1 477/4885VCP 1096/4885HRH3 2037/4885
US-20230110180-A1 CDK2 DEGRADERS AND USES THEREOF CDK2, CDK20, CDK1 NPC1 4506/4885VCP 2794/4885HRH3 3830/4885

“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.

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