SCHEMBL7513252

SCHEMBL7513252

O=C(CC1(C(=O)N[C@@H](Cc2ccc(-c3cccc(Cl)c3)cc2)c2nnn[nH]2)CCCC1)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR34 Q9UPC5 3/20 0.42
MMEL1 Q495T6 7/20 0.41
F11 P03951 2/20 0.38
ACE P12821 2/20 0.38
EMG1 Q92979 1/20 0.38
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
MME P08473 3/20 0.37
TACR1 P25103 1/20 0.37
CDK2 P24941 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
SCHEMBL7507651 0.91 PPARG (0.39) MMEL1MAPTMMETACR1
SCHEMBL7508372 0.89 ITGB1 (0.40) MMETACR1
SCHEMBL6125680 0.89 MMEL1 (0.48) MMEL1ACEMME
SCHEMBL3699639 0.89 MMEL1 (0.48) MMEL1ACEMME
SCHEMBL7507633 0.84 MME (0.44) GPR34MMEL1ACEEMG1MEN1
SCHEMBL3707948 0.81 ITGB1 (0.43) MMEL1MME
SCHEMBL16214799 0.81 ITGB1 (0.39) MMEL1F11MME
SCHEMBL3701267 0.79 MME (0.43) MMEL1KMT2AMMECDK2
SCHEMBL3696881 0.79 MME (0.43) MMEL1KMT2AMMECDK2
SCHEMBL7507623 0.79 MME (0.45) MME

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
US-8877815-B2 Substituted carbamoylcycloalkyl acetic acid derivatives as NEP NOVARTIS AG (CH) 2014-11-04 US disclosed
US-8877815-B2 Substituted carbamoylcycloalkyl acetic acid derivatives as NEP NOVARTIS AG (CH) 2014-11-04 US disclosed
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP NOVARTIS AG (CH) 2012-05-17 US disclosed
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP NOVARTIS AG (CH) 2012-05-17 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-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP MME, REN, ECE1 GPR34 1340/4885MMEL1 1000/4885F11 532/4885

“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.