SCHEMBL2802265

SCHEMBL2802265

[CH2]C(CCCC)OCCC

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.35
CYP3A4 P08684 2/20 0.31
ALDH1A1 P00352 4/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 3/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL27774606 0.91 LMNA (0.38) DNM1TSHRFDPS
SCHEMBL3391758 0.90 ADRB2 (0.36) DNM1CYP3A4ALDH1A1TDP1TSHR
SCHEMBL6702494 0.89 TSHR (0.43) DNM1ALDH1A1TSHRCA1CA2
SCHEMBL2803830 0.84
SCHEMBL27882987 0.83 DNM1 (0.39) DNM1ALDH1A1TSHRADRB2ADRB1
SCHEMBL3389854 0.82 CYP3A4 (0.32) DNM1CYP3A4ALDH1A1TSHR
SCHEMBL11823405 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL386798 0.82
SCHEMBL21224549 0.81 DNM1 (0.42) DNM1TSHRFDPS
SCHEMBL21225211 0.81 DNM1 (0.42) DNM1TSHRFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404860-B2 Compound having hydantoin ring and method of producing the same TOKUYAMA CORPORATION (JP) 2013-03-26 US disclosed
US-20120289705-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME SHIIGI HIROFUMI (JP) 2012-11-15 US disclosed
US-8258313-B2 Compound having hydantoin ring and method of producing the same TOKUYAMA CORPORATION (JP) 2012-09-04 US disclosed
US-20100184993-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2010-07-22 US disclosed
EP-2172459-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME Tokuyama Corporation (JP) 2010-04-07 EP disclosed
EP-1556346-A1 1-PHENYLPYRROLIDINE-2-ONE-3-CARBOXAMIDES BASF AKTIENGESELLSCHAFT (DE) 2005-07-27 EP disclosed
WO-2004037787-A1 1-PHENYLPYRROLIDINE-2-ONE-3-CARBOXAMIDES BASF AKTIENGESELLSCHAFT (DE) 2004-05-06 WO disclosed
CN-1105799-A Carbostyril derivatives as matrix metalloproteinases inhibitors OTSUKA PHARMA CO LTD (JP) 1995-07-26 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 (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-20120289705-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME CASP14, CYP8B1, DDT DNM1 1318/4885CYP3A4 92/4885ALDH1A1 2059/4885
US-20100184993-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME CASP14, CYP8B1, DDT DNM1 1318/4885CYP3A4 92/4885ALDH1A1 2059/4885

“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.