SCHEMBL10252545

SCHEMBL10252545

CC1C[C@@H](Cc2ccc(-c3ccccc3)cc2)N(C(=O)C(C)(C)C)C1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ABCC4 O15439 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ MMP12 P39900 1/20 0.35
▸ MMP13 P45452 1/20 0.35
▸ FASN P49327 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34

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
SCHEMBL10258235 0.86 CETP (0.44) KMT2ACYP3A4KDM4EALDH1A1ABCB1
SCHEMBL10257175 0.80 HTR2C (0.50) SMN1; SMN2KMT2AMEN1NPC1RAB9A
SCHEMBL10251800 0.80 RIPK1 (0.38) SMN1; SMN2TSHRKMT2AMEN1CYP3A4
SCHEMBL21310317 0.78 GRM2 (0.40) RIPK1GRM2
SCHEMBL10257159 0.77 CCR5 (0.36) SMN1; SMN2TSHRKMT2AMEN1MAPT
SCHEMBL18175828 0.76 CYP3A4 (0.36) SMN1; SMN2TSHRKMT2AHPGDCYP3A4
SCHEMBL1908573 0.76 SMN1; SMN2 (0.38) SMN1; SMN2TSHRKMT2AMEN1NPC1
SCHEMBL597215 0.76 SMN1; SMN2 (0.38) SMN1; SMN2TSHRKMT2AMEN1NPC1
SCHEMBL9974772 0.76 CYP3A4 (0.36) SMN1; SMN2TSHRKMT2AHPGDCYP3A4
SCHEMBL9929765 0.76 CYP3A4 (0.36) SMN1; SMN2TSHRKMT2AHPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142916-A1 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID NOVARTIS AG (CH) 2012-06-07 — — 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-20120142916-A1 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID MME, REN, PAH SMN1; SMN2 1166/4885TSHR 2857/4885KMT2A 1209/4885

“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.

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