SCHEMBL29366960

SCHEMBL29366960

N#Cc1ccc2c(c1)COC2=O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 6/20 0.65
KCNJ1 P48048 9/20 0.59
KCNH2 Q12809 8/20 0.59
MAPT P10636 2/20 0.56
LMNA P02545 2/20 0.56
GAA P10253 1/20 0.56
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
RECQL P46063 1/20 0.50
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL1641 1.00 PRF1 (0.65) PRF1KCNJ1KCNH2MAPTLMNA
Tetrahydrofuran SCHEMBL22089885 0.91 PRF1 (0.56) PRF1KCNJ1KCNH2MAPTLMNA
Toluene SCHEMBL28417431 0.89 PRF1 (0.55) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL148003 0.86 PRF1 (0.54) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL28914301 0.83 PRF1 (0.59) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL29933676 0.83 PRF1 (0.59) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL22089880 0.83 PRF1 (0.49) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL24442281 0.82 MAPT (0.56) PRF1KCNJ1KCNH2MAPTLMNA
SCHEMBL13454843 0.79 GRM5 (0.59) PRF1MAPTLMNAGAAMAOA
SCHEMBL31503953 0.79 PRF1 (0.43) PRF1KCNJ1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3896057-B1 METHOD FOR CONTINUOUSLY PREPARING CITALOPRAM DIOL ZHEJIANG HUAHAI PHARM CO LTD (CN) 2023-05-31 EP claimed
US-20250092020-A1 IDO/TDO Inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-03-20 US disclosed
EP-4217412-A1 WASTE MITIGATION METHODS AND MATERIALS Finite Research Ltd (GB) 2023-08-02 EP disclosed
WO-2022151968-A1 METHOD FOR PURIFYING KEY INTERMEDIATES OF CITALOPRAM 浙江华海药业股份有限公司 2022-07-21 WO disclosed
WO-2022023916-A1 WASTE MITIGATION METHODS AND MATERIALS LI, Zhenzhen (CN) 2022-02-03 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-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 PRF1 3914/4885KCNJ1 3877/4885KCNH2 2564/4885

“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.