SCHEMBL22777905

SCHEMBL22777905

O=C(O)NCC#Cc1cnc(N2CCC(c3c[nH]c4nnc(-c5ccccc5O)cc34)CC2)nc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 6/20 0.36
▸ SMARCA2 P51531 4/20 0.36
▸ SMARCA4 P51532 4/20 0.36
▸ BTK Q06187 1/20 0.35
▸ CAMKK2 Q96RR4 1/20 0.35
▸ AXL P30530 6/20 0.35
▸ HSD11B1 P28845 3/20 0.33
▸ MAPT P10636 1/20 0.33
▸ IKBKB O14920 2/20 0.33
▸ CHUK O15111 1/20 0.33
▸ BRD4 O60885 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
SCHEMBL30382571 0.90 SMARCA2 (0.38) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777883 0.90 SMARCA2 (0.38) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777857 0.90 PBRM1 (0.40) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777912 0.84 BTK (0.37) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777839 0.82 PBRM1 (0.41) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777874 0.82 PBRM1 (0.37) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777871 0.82 PBRM1 (0.37) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777907 0.82 PBRM1 (0.37) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL22777902 0.82 PBRM1 (0.38) PBRM1SMARCA2SMARCA4BTKCAMKK2
SCHEMBL25468671 0.81 PTPN11 (0.41) BTKMAPT

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-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-18 — — US disclosed
WO-2020251972-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 — — 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-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCB1, SMARCE1 PBRM1 5/4885SMARCA2 6/4885SMARCA4 7/4885

“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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