SCHEMBL3431297

SCHEMBL3431297

C=CCCCCC[C@H](C)C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
ALDH1A1 P00352 5/20 0.49
USP2 O75604 4/20 0.49
CYP3A4 P08684 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 1/20 0.49
ABCC4 O15439 1/20 0.45
LMNA P02545 2/20 0.44
RECQL P46063 1/20 0.42
TSHR P16473 2/20 0.41
PLA2G2C Q5R387 1/20 0.38
LPAR2 Q9HBW0 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
CA1 P00915 2/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL3116277 1.00 MAPT (0.49) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3127325 1.00 MAPT (0.49) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL25923178 0.98 MAPT (0.46) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3117140 0.98 MAPT (0.46) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3120777 0.92 ALDH1A1 (0.40) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3116666 0.85
SCHEMBL1524396 0.84 MAPT (0.50) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL7560013 0.84 MAPT (0.50) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL723135 0.84 MAPT (0.50) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL7558719 0.84 MAPT (0.50) MAPTALDH1A1USP2CYP3A4SMN1; SMN2

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-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-19 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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION VIP, EIF2AK2, PREP MAPT 4366/4885ALDH1A1 1706/4885USP2 2287/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 MAPT 3535/4885ALDH1A1 2694/4885USP2 4286/4885

“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.