SCHEMBL5888976

SCHEMBL5888976

CCCCCN(CCCCC)c1cccs1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KCNH2 Q12809 1/20 0.35
HDAC3 O15379 1/20 0.35
KMT2A Q03164 1/20 0.34
LMNA P02545 4/20 0.33
HTT P42858 3/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 3/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
DNM1 Q05193 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL84309 0.94 KMT2A (0.38) HDAC1HDAC11HDAC8HDAC6HDAC3
SCHEMBL4757636 0.83 HDAC1 (0.39) HDAC1HDAC11HDAC8HDAC6KCNH2
SCHEMBL325229 0.80 KMT2A (0.38) HDAC1HDAC11HDAC8HDAC6HDAC3
SCHEMBL27459264 0.78 ALDH1A1 (0.37) KCNH2KMT2ALMNAMAPTPOLB
SCHEMBL84280 0.77 ALDH1A1 (0.41) KCNH2KMT2ALMNAMAPTNPSR1
SCHEMBL4756582 0.77 KMT2A (0.40) HDAC1HDAC11HDAC8HDAC6HDAC3
SCHEMBL6642474 0.76 KMT2A (0.36) HDAC1HDAC11HDAC8HDAC6HDAC3
Fluoride SCHEMBL28515671 0.75 ALDH1A1 (0.40) KCNH2KMT2ALMNAMAPTNPSR1
SCHEMBL11199571 0.75 NPC1 (0.44) HDAC1HDAC11HDAC8HDAC6HDAC3
SCHEMBL11199615 0.75 NPC1 (0.48) HDAC1HDAC11HDAC8HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024008805-A1 HETEROAROMATIC KETONES AND THEIR USE IN RADICAL AND CATIONIC POLYMERIZATION PHOSUMA PHOTONIC & SUSTAINABLE MATERIALS GMBH (DE) 2024-01-11 WO disclosed
US-6984737-B2 Di(het)arylaminothiophene derivatives SIEMENS AKTIENGESELLSCHAFT (DE) 2006-01-10 US disclosed
US-20030137240-A1 Di(het)arylaminothiophene derivatives OSRAM OLED GMBH (DE) 2003-07-24 US disclosed
JP-2000256352-A PRODUCTION OF (DIARYLAMINO)THIOPHENE TOSOH CORP 2000-09-19 JP 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-20030137240-A1 Di(het)arylaminothiophene derivatives PTGER4, LTB4R2, ALOX5 HDAC1 3812/4885HDAC11 3650/4885HDAC8 3824/4885

“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.