SCHEMBL24371171

SCHEMBL24371171

CC(C)c1cc2c(C(C)C)cccc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.42
SLC2A1 P11166 1/20 0.42
KIF11 P52732 2/20 0.41
GABRA1 P14867 3/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
HPGD P15428 2/20 0.39
GABRB2 P47870 2/20 0.39
FAAH O00519 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
GABRB1 P18505 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39
GABRA5 P31644 1/20 0.39

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
SCHEMBL15042893 0.86 DHFR (0.41) DHFRSLC2A1KIF11GABRA1GABRG2
SCHEMBL24804024 0.81 CYP1A2 (0.47) KIF11GABRA1GABRG2GABRB3HPGD
SCHEMBL19737437 0.81 DAO (0.50) DHFRSLC2A1KIF11HPGDCYP1A2
SCHEMBL15042892 0.80 DHFR (0.49) DHFRSLC2A1KIF11GABRA1GABRG2
SCHEMBL16380970 0.79 DAO (0.49) DHFRSLC2A1KIF11HPGDCYP1A2
SCHEMBL16380899 0.79 DAO (0.49) DHFRSLC2A1KIF11HPGDALDH1A1
SCHEMBL16380895 0.79 DHFR (0.48) DHFRSLC2A1KIF11HPGDCYP3A4
SCHEMBL24447564 0.79 RHEB (0.42) DHFRSLC2A1KIF11HPGDALDH1A1
SCHEMBL24236481 0.77 MEN1 (0.50) DHFRSLC2A1CA1CA2
SCHEMBL21151024 0.77 KIF11 (0.49) DHFRSLC2A1KIF11GABRA1HPGD

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-20240018102-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY Lhotse Bio, Inc (US) 2024-01-18 US disclosed
US-20240018102-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY Lhotse Bio, Inc (US) 2024-01-18 US disclosed
US-11572370-B2 CD16A binding agents and uses thereof BIOHAVEN THERAPEUTICS LTD. (US) 2023-02-07 US disclosed
WO-2022083703-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY LHOTSE BIO, INC. (US) 2022-04-28 WO 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-20240018102-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY LPAR1, LPAR2, LPAR5 DHFR 2241/4885SLC2A1 2023/4885KIF11 2621/4885
US-11572370-B2 CD16A binding agents and uses thereof FCGR1A, FCGR2A, FCGR3B DHFR 3003/4885SLC2A1 3288/4885KIF11 3592/4885

“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.