SCHEMBL3190604

SCHEMBL3190604

CCOC(=O)CNC(=O)NCc1ccccc1-c1ccc(C(C)(C)CCCCC(=O)N2CCOCC2)cc1O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.41
CNR2 P34972 8/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 2/20 0.39
PPID Q08752 1/20 0.39
LMNA P02545 3/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
AVPR2 P30518 1/20 0.37

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
SCHEMBL3190487 0.90 CNR1 (0.41) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3180971 0.88 CNR1 (0.43) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3187288 0.87 PPID (0.46) CNR1CNR2RAB9AL3MBTL1POLB
SCHEMBL3187490 0.86 POLB (0.39) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3180943 0.83 MAPT (0.44) CNR1CNR2RAB9APOLBTP53
SCHEMBL3199031 0.82 ALDH1A1 (0.43) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3189090 0.82 ALDH1A1 (0.39) CNR1CNR2RAB9APOLBLMNA
SCHEMBL13255046 0.82 RAB9A (0.40) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3191831 0.82 GFER (0.39) CNR1CNR2RAB9APOLBLMNA
SCHEMBL3189116 0.82 RAB9A (0.45) CNR1CNR2RAB9AL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168108-A1 PHENYL DERIVATIVES AND METHODS OF USE ADOLOR CORPORATION (US) 2010-07-01 US claimed
US-20060074086-A1 Phenyl derivatives and methods of use ADOLOR CORPORATION (US) 2006-04-06 US claimed
US-20100168108-A1 PHENYL DERIVATIVES AND METHODS OF USE ADOLOR CORPORATION (US) 2010-07-01 US disclosed
US-20100168108-A1 PHENYL DERIVATIVES AND METHODS OF USE ADOLOR CORPORATION (US) 2010-07-01 US disclosed
US-20100168108-A1 PHENYL DERIVATIVES AND METHODS OF USE ADOLOR CORPORATION (US) 2010-07-01 US disclosed
US-7671052-B2 Phenyl derivatives and methods of use ADOLOR CORPORATION (US) 2010-03-02 US disclosed
US-7671052-B2 Phenyl derivatives and methods of use ADOLOR CORPORATION (US) 2010-03-02 US disclosed
US-7671052-B2 Phenyl derivatives and methods of use ADOLOR CORPORATION (US) 2010-03-02 US disclosed
US-20060074086-A1 Phenyl derivatives and methods of use ADOLOR CORPORATION (US) 2006-04-06 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 (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-20060074086-A1 Phenyl derivatives and methods of use CNR2, CNR1, GPR119 CNR1 2/4885CNR2 1/4885RAB9A 2079/4885
US-20100168108-A1 PHENYL DERIVATIVES AND METHODS OF USE CNR2, CNR1, GPR119 CNR1 2/4885CNR2 1/4885RAB9A 2079/4885

“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.