SCHEMBL3384529

SCHEMBL3384529

O=Cc1ccc(C(=O)Cl)o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 7/20 0.42
TDP1 Q9NUW8 2/20 0.42
GAA P10253 1/20 0.41
POLB P06746 4/20 0.40
LMNA P02545 2/20 0.40
CSF1R P07333 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 1/20 0.37
LDHA P00338 1/20 0.37
LDHB P07195 1/20 0.37
HAO1 Q9UJM8 1/20 0.37
HDAC4 P56524 3/20 0.36
HDAC1 Q13547 3/20 0.36
HPGD P15428 1/20 0.36
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 2/20 0.35

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
SCHEMBL86396 0.80 KDM4E (0.52) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL17495564 0.80 KDM4E (0.52) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL28611785 0.78 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL13637612 0.78 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL13524319 0.78 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL11805964 0.78 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL1355720 0.78 MAPT (0.39) ALDH1A1TDP1HTTHPGDMAPT
SCHEMBL23828689 0.77 ALDH1A1 (0.48) ALDH1A1TSHRKDM4ETDP1GAA
Methane SCHEMBL16742564 0.77 ALDH1A1 (0.44) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL26696157 0.75 ALDH1A1 (0.47) ALDH1A1TSHRKDM4ETDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112625014-B Method for preparing 2, 5-furan diformyl chloride from 5-chloromethyl furfural 国网安徽省电力有限公司电力科学研究院 2023-05-23 CN disclosed
CN-112552269-A Method for synthesizing 2, 5-furan diformyl chloride in one step 国网安徽省电力有限公司电力科学研究院 2021-03-26 CN disclosed
CN-105658612-A Methods and compounds for producing nylon 6,6 英派尔科技开发有限公司 2016-06-08 CN disclosed
EP-1771432-B1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-08 EP disclosed
US-20080317671-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS CARRUTHERS NICHOLAS I 2008-12-25 US disclosed
US-7429659-B2 Furan compounds as histamine H3 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-30 US disclosed
CN-1960981-A As histamine H3Non-imidazole heterocyclic compounds as receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2007-05-09 CN disclosed
EP-1771432-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-11 EP disclosed
WO-2005096734-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-20 WO disclosed
US-20050222129-A1 Non-imidazole heterocyclic compounds JANSSEN PHARMACEUTICAL, N.V. (BE) 2005-10-06 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-20050222129-A1 Non-imidazole heterocyclic compounds HRH3, HRH4, HRH2 ALDH1A1 2417/4885TSHR 655/4885KDM4E 845/4885
US-20080317671-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS HRH3, HRH4, HRH2 ALDH1A1 2417/4885TSHR 655/4885KDM4E 845/4885

“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.