SCHEMBL24828036

SCHEMBL24828036

CC(C)(C)Cc1cnc(N2CC3(CCN(C(C)(C)C)CC3)C2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 15/20 0.40
▸ ALDH1A1 P00352 11/20 0.40
▸ HPGD P15428 10/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ USP2 O75604 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ CYP2D6 P10635 5/20 0.34
▸ CYP1A2 P05177 4/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ KCNH2 Q12809 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
SCHEMBL24828044 0.85 HSD17B10 (0.38) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL24827912 0.83 HSD17B10 (0.39) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL24827851 0.82 HSD17B10 (0.42) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL9944495 0.73 NPC1 (0.44) ALDH1A1KDM4ENPC1RAB9ACYP2D6
SCHEMBL22737504 0.72 HSD17B10 (0.43) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL24827911 0.71 CYP3A4 (0.35) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL17404871 0.71 CYP2D6 (0.42) HSD17B10ALDH1A1CYP3A4USP2CYP2D6
SCHEMBL22737332 0.71 HSD17B10 (0.42) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL24827913 0.71 CYP3A4 (0.36) HSD17B10ALDH1A1HPGDCYP3A4USP2
SCHEMBL17404868 0.70 CYP3A4 (0.36) HSD17B10ALDH1A1HPGDCYP3A4USP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230248833-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-10 — — US disclosed
US-20230248833-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-10 — — US disclosed
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 (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-11542266-B1 Substituted piperidines as BTK inhibitors BTK, BLK, SYK HSD17B10 4570/4885ALDH1A1 3396/4885HPGD 4322/4885
US-20230248833-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR BTK, WEE1, WEE2 HSD17B10 1782/4885ALDH1A1 3737/4885HPGD 2058/4885

“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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