SCHEMBL24048567

SCHEMBL24048567

Clc1ccc(Br)c2c1sc1cc3ccccc3cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
MAPT P10636 1/20 0.32
PTPN1 P18031 1/20 0.31
CYP2A6 P11509 1/20 0.31
PLK4 O00444 2/20 0.31
AURKA O14965 2/20 0.31
DAPK3 O43293 2/20 0.31
CDK1 P06493 2/20 0.31
PIM1 P11309 2/20 0.31
CDK2 P24941 2/20 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
SCHEMBL22310923 0.80 PTPN1 (0.42) HDAC1HDAC8HDAC6MAPTPTPN1
SCHEMBL23168601 0.79 CYP2A6 (0.34) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL24048270 0.77 CYP2A6 (0.41) PTPN1CYP2A6PLK4AURKADAPK3
SCHEMBL24048050 0.76 CYP1A1 (0.43) MAPTCYP2A6PLK4AURKADAPK3
SCHEMBL24047882 0.76 MAPT (0.33) MAPTCYP2A6
SCHEMBL24048452 0.76 ASIC3 (0.30)
SCHEMBL22311342 0.75 MAPT (0.32) MAPTCYP2A6
SCHEMBL24210392 0.73 CYP1A2 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL24047500 0.73 MAPT (0.35) MAPTCYP2A6CSNK2A1
SCHEMBL22133393 0.73 GPR3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2

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-20230337531-A1 NOVEL COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2023-10-19 US disclosed
US-20230337531-A1 NOVEL COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2023-10-19 US disclosed
WO-2021235830-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-11-25 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-20230337531-A1 NOVEL COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CRY1, AHR, CRY2 HDAC3 2156/4885HDAC4 2475/4885HDAC1 1723/4885

“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.