SCHEMBL4848636

SCHEMBL4848636

C=CC=C1OC(=O)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 4/20 0.55
HPGD P15428 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
MAPK1 P28482 2/20 0.53
TSHR P16473 1/20 0.53
ALOX15 P16050 1/20 0.52
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
TRPA1 O75762 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 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
SCHEMBL31012425 1.00 KDM4E (0.55) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL304550 0.78 ALDH1A1 (0.59) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL304549 0.78 ALDH1A1 (0.59) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL15470518 0.76 ALDH1A1 (0.55) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL22827822 0.75 STK17B (0.59) TDP1MAPK1MEN1KMT2AMAOA
SCHEMBL19244126 0.74 ALDH1A1 (0.59) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL2606686 0.74 ALDH1A1 (0.62) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL22799287 0.74 ALDH1A1 (0.59) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL11215773 0.74 ALDH1A1 (0.59) KDM4EALDH1A1HPGDL3MBTL1TDP1
SCHEMBL13062771 0.74 ALDH1A1 (0.62) KDM4EALDH1A1HPGDL3MBTL1TDP1

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
JP-2167216-A None JP disclosed
US-20080146576-A1 N-(1-Phthalazin-1-ylpiperidin-4-yl)amides as EP2 receptor modulators BAYER SCHERING PHARMA AG (DE) 2008-06-19 US disclosed
WO-2008028689-A1 N-(1-PHTHALAZIN-1-YLPIPERIDIN-4-YL)AMIDES AS EP2 RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 WO disclosed
JP-2006151842-A METHOD FOR PRODUCING OPTICALLY ACTIVE ALKYLPHTHALIDE COMPOUND TAKASAGO INTERNATL CORP 2006-06-15 JP disclosed
JP-H02167216-A BATHING AGENT KAO CORP 1990-06-27 JP 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-20080146576-A1 N-(1-Phthalazin-1-ylpiperidin-4-yl)amides as EP2 receptor modulators PTGER2, PTGER1, PTGDR2 KDM4E 2500/4885ALDH1A1 1023/4885HPGD 473/4885

“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.