SCHEMBL7217397

SCHEMBL7217397

COC(=O)c1cc2cc(OC)ccc2n1CCN1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MTNR1A P48039 2/20 0.51
MTNR1B P49286 2/20 0.51
MAPK1 P28482 1/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CNR2 P34972 2/20 0.49
PTGS2 P35354 1/20 0.49
POLB P06746 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
CNR1 P21554 1/20 0.48

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
SCHEMBL4539709 0.91 ALDH1A1 (0.57) L3MBTL1KDM4EALDH1A1MAPTHPGD
SCHEMBL669395 0.82 CREBBP (0.53) ALDH1A1LMNACYP1A2CNR2POLB
SCHEMBL7216990 0.79 CNR2 (0.61) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL706526 0.78 MTNR1A (0.58) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL12950442 0.78 CNR1 (0.50) KDM4EALDH1A1MAPTCYP1A2CNR2
SCHEMBL15681599 0.76 ALDH1A1 (0.53) ALDH1A1HPGDHSD17B10MAPK1
SCHEMBL5426590 0.74 L3MBTL1 (1.00) L3MBTL1KDM4EALDH1A1MAPTHPGD
SCHEMBL23927917 0.74 HTR7 (0.58) KDM4EALDH1A1MAPTMTNR1AMTNR1B
SCHEMBL30187142 0.73 CNR2 (0.69) KDM4EALDH1A1HPGDHSD17B10CNR2
SCHEMBL24937543 0.73 CNR2 (0.69) KDM4EALDH1A1HPGDHSD17B10CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6653304-B2 Antiarthritic agents; skin disorders; anticarcinogenic agents BRISTOL-MYERS SQUIBB CO. 2003-11-25 US disclosed
US-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases BRISTOL-MYERS SQUIBB COMPANY 2002-08-29 US 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-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases CNR1, CNR2, GPR18 L3MBTL1 2711/4885KDM4E 1495/4885ALDH1A1 3321/4885

“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.