SCHEMBL25456750

SCHEMBL25456750

CCCc1ccc(CCCCCCCCC(=O)N(CCOP(=O)(O)O)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ ALOX5 P09917 2/20 0.48
▸ LTB4R2 Q9NPC1 2/20 0.47
▸ CA12 O43570 4/20 0.47
▸ CA1 P00915 4/20 0.47
▸ CA2 P00918 4/20 0.47
▸ CA4 P22748 3/20 0.47
▸ LPAR1 Q92633 7/20 0.47
▸ KDM4A O75164 1/20 0.45
▸ KDM5A P29375 1/20 0.45
▸ KDM4C Q9H3R0 1/20 0.45
▸ PHF8 Q9UPP1 1/20 0.45
▸ KDM2A Q9Y2K7 1/20 0.45
▸ CNR2 P34972 1/20 0.44

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
SCHEMBL25456753 0.86 ALOX5 (0.52) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL25456795 0.85 ALOX5 (0.48) LMNATSHRALOX5
Ammonia Solution, Strong SCHEMBL25172939 0.85 ALOX5 (0.51) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL25456778 0.84 RAF1 (0.50) —
Ammonia Solution, Strong SCHEMBL25175634 0.84 ALOX5 (0.47) ALOX5
Ammonia Solution, Strong SCHEMBL25167613 0.84 ALOX5 (0.47) LMNATSHRALOX5
Ammonia Solution, Strong SCHEMBL25169881 0.83 RAF1 (0.49) —
Ammonia Solution, Strong SCHEMBL25175635 0.83 ALOX5 (0.52) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL25456788 0.82 ALOX5 (0.48) ALOX5LTB4R2LPAR1
Ammonia Solution, Strong SCHEMBL30433652 0.80 TRPM8 (0.40) LPAR1

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-11802135-B2 Lysophosphatidic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-31 — — US disclosed
US-11802135-B2 Lysophosphatidic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-31 — — US disclosed
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-05-11 — — US disclosed
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-05-11 — — 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-11802135-B2 Lysophosphatidic acid derivative LPAR4, LPAR2, LPAR1 NPC1 1290/4885LMNA 1148/4885ALOX15 149/4885
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE LPAR4, LPAR2, LPAR1 NPC1 1394/4885LMNA 1415/4885ALOX15 186/4885

“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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