SCHEMBL23607128

SCHEMBL23607128

O=C(Nc1nc(N2CCNCC2)cs1)c1ncccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.46
▸ HDAC2 Q92769 4/20 0.43
▸ CHEK1 O14757 5/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ HDAC1 Q13547 2/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ PRKCA P17252 2/20 0.40
▸ PRKCQ Q04759 2/20 0.40
▸ PRKCD Q05655 2/20 0.40
▸ PLD1 Q13393 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ EGLN2 Q96KS0 1/20 0.38
▸ FTO Q9C0B1 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL23607113 0.83 NPC1 (0.57) HDAC2CHEK1HDAC1HDAC3IRAK4
SCHEMBL23607123 0.80 PRKCA (0.48) PIM1CHEK1PTPN11PRKCAPRKCQ
SCHEMBL23607121 0.76 ATR (0.51) PIM1HDAC2HDAC1HDAC3KDM4E
SCHEMBL25131885 0.75 KDM4E (0.52) PIM1HDAC2CHEK1PTPN11HDAC1
SCHEMBL23607127 0.72 PIM1 (0.44) PIM1PIM3EGLN2FTO
SCHEMBL25132256 0.70 PIM1 (0.49) PIM1PIM3EGLN2FTO
SCHEMBL14284386 0.69 NPC1 (0.61) NPC1RAB9AL3MBTL1
SCHEMBL23607118 0.68 PIM1 (0.49) PIM1HDAC2CHEK1PTPN11HDAC1
SCHEMBL24107779 0.66 CHRNB2 (0.50) HDAC2CHEK1HDAC1HDAC3
SCHEMBL30292566 0.65 PIM1 (0.41) PIM1HDAC2CHEK1HDAC1HDAC3

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-20230103415-A1 SMARCA INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-06 — — US disclosed
WO-2021133917-A1 SMARCA INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-07-01 — — 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-20230103415-A1 SMARCA INHIBITORS AND USES THEREOF SMARCC1, SMARCE1, SMARCA1 PIM1 1216/4885HDAC2 250/4885CHEK1 111/4885

“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.

Send feedback