SCHEMBL3375102

SCHEMBL3375102

COc1cc(O)c(Cl)cc1C=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TSHR P16473 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
DPP4 P27487 13/20 0.55
ERN1 O75460 5/20 0.54
CYP1A1 P04798 1/20 0.49
CYP1B1 Q16678 1/20 0.49
PREP P48147 1/20 0.46
DPP9 Q86TI2 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL29933323 1.00 KDM4E (0.57) KDM4EALDH1A1TSHRTDP1DPP4
SCHEMBL22231506 0.93 ALDH1A1 (0.57) KDM4EALDH1A1TSHRTDP1DPP4
SCHEMBL3644816 0.85 ERN1 (0.54) KDM4EALDH1A1TSHRTDP1DPP4
SCHEMBL769297 0.84 ALDH1A1 (0.65) KDM4EALDH1A1TSHRTDP1ERN1
SCHEMBL1187473 0.84 ALDH1A1 (0.65) KDM4EALDH1A1TSHRTDP1ERN1
SCHEMBL29459727 0.82 ALDH1A1 (0.69) KDM4EALDH1A1TSHRTDP1ERN1
SCHEMBL9818754 0.82 ALDH1A1 (0.63) KDM4EALDH1A1TSHRTDP1ERN1
SCHEMBL7401545 0.82 ALDH1A1 (0.69) KDM4EALDH1A1TSHRTDP1DPP4
SCHEMBL1002368 0.82 ALDH1A1 (0.69) KDM4EALDH1A1TSHRTDP1ERN1
SCHEMBL11044996 0.79 ALDH1A1 (0.59) KDM4EALDH1A1TSHRTDP1DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112812113-B Immunomodulatory compounds, compositions and uses thereof 杭州和正医药有限公司 2022-09-20 CN disclosed
CN-112812113-A Immunomodulatory compounds, compositions and uses thereof 杭州和正医药有限公司 2021-05-18 CN disclosed
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP disclosed
US-7812040-B2 such as 3-(3-Acetyl-phenyl)-1-[3-(3-chloro-4-pyrrolidin-1-ylmethyl-phenoxy)-cyclobutylmethyl]-1-methyl-urea, used for the treatment of , schizophrenia, Alzheimer's disease, attention-deficit hyperactivity disorder, hypotension, allergies, cardiovascular, gastrointestinal and psychological disorders PFIZER INC. (US) 2010-10-12 US disclosed
US-20090131433-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER INC. (US) 2009-05-21 US disclosed
EP-1899296-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2008-03-19 EP disclosed
WO-2006136924-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-12-28 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-20090131433-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS HRH3, HRH4, HRH2 KDM4E 3381/4885ALDH1A1 923/4885TSHR 446/4885

“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.