SCHEMBL4644491

SCHEMBL4644491

Cc1cccc(OC(=O)CCl)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
GAA P10253 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPT P10636 3/20 0.47
MAPK1 P28482 1/20 0.45
HTR1B P28222 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43

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
SCHEMBL10425437 0.85 POLB (0.54) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL10500417 0.85 TDP1 (0.55) ALDH1A1CYP1A2L3MBTL1TUBB4ATUBB
SCHEMBL28875517 0.84 TDP1 (0.54) ALDH1A1CYP1A2L3MBTL1TUBB4ATUBB
SCHEMBL1750794 0.84 POLB (0.53) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL30932948 0.82 POLB (0.51) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL18076011 0.82 POLB (0.51) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL10610842 0.81 POLB (0.50) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL27942332 0.81 MEN1 (0.50) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL8463126 0.79 POLB (0.56) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7221502 0.79 SMN1; SMN2 (0.61) MEN1KMT2AALDH1A1CYP3A4GAA

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-2016147133-A1 PROCESS FOR THE PREPARATION OF DROXIDOPA Piramal Enterprises Limited (IN) 2016-09-22 WO disclosed
US-20160251320-A1 Compounds UNIVERSITÉ CLAUDE BERNARD LYON 1 (FR) 2016-09-01 US disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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-20160251320-A1 Compounds NISCH, MDN1, PIR POLB 903/4885MEN1 4/4885KMT2A 4253/4885

“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.