SCHEMBL24827911

SCHEMBL24827911

CC(C)c1cnc(N2CCC3(CC2)CN(C(C)(C)C)C3)nc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.35
▸ CYP2D6 P10635 3/20 0.35
▸ TSHR P16473 3/20 0.35
▸ HSD17B10 Q99714 5/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ OGA O60502 6/20 0.34
▸ PANK3 Q9H999 1/20 0.33
▸ ACACB O00763 4/20 0.32
▸ CYP1A2 P05177 1/20 0.31

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
SCHEMBL24827913 0.82 CYP3A4 (0.36) CYP3A4CYP2D6TSHRHSD17B10ALDH1A1
SCHEMBL24827889 0.82 CYP3A4 (0.36) CYP3A4CYP2D6TSHRHSD17B10ALDH1A1
SCHEMBL24827960 0.82 OGA (0.40) OGAPANK3
SCHEMBL26815219 0.78 CYP3A4 (0.36) CYP3A4CYP2D6TSHRHSD17B10ALDH1A1
SCHEMBL17404868 0.75 CYP3A4 (0.36) CYP3A4CYP2D6TSHRHSD17B10ALDH1A1
SCHEMBL16131123 0.74 POLB (0.42) TSHRALDH1A1MEN1KMT2AHPGD
SCHEMBL26846118 0.74 OGA (0.39) CYP3A4CYP2D6TSHRMEN1KMT2A
SCHEMBL26844919 0.74 ACACB (0.36) CYP3A4CYP2D6TSHRMEN1KMT2A
SCHEMBL13131096 0.73 USP2 (0.40) CYP3A4CYP2D6TSHRHSD17B10MEN1
SCHEMBL11947825 0.73 CYP3A4 (0.53) CYP3A4CYP2D6TSHRHSD17B10ALDH1A1

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-11542266-B1 Substituted piperidines as BTK inhibitors HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-01-03 — — 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-11542266-B1 Substituted piperidines as BTK inhibitors BTK, BLK, SYK CYP3A4 4146/4885CYP2D6 3342/4885TSHR 1880/4885

“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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