SCHEMBL25201237

SCHEMBL25201237

COC(=O)c1c(F)cc(C(F)(F)F)c(C(=O)O)c1C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.40
CFTR P13569 2/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.35
ACHE P22303 1/20 0.35
NPC1 O15118 2/20 0.35
PKM P14618 1/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LDHA P00338 1/20 0.34
AR P10275 1/20 0.34
LMNA P02545 1/20 0.34
SOS1 Q07889 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
DHODH Q02127 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
CISD2 Q8N5K1 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
SCHEMBL25180399 0.82 TSHR (0.37) NOTUMCFTRALDH1A1L3MBTL1LMNA
SCHEMBL29090594 0.82 NOTUM (0.40) NOTUMCFTRCYP3A4ACHEAR
SCHEMBL30867498 0.82 CFTR (0.44) NOTUMCFTRCYP3A4ACHEAR
SCHEMBL25174744 0.82 CFTR (0.44) NOTUMCFTRCYP3A4ACHEAR
SCHEMBL30867275 0.82 NOTUM (0.40) NOTUMCFTRCYP3A4ACHEAR
SCHEMBL25180891 0.82 SOS1 (0.46) NOTUMCFTRMEN1KMT2ACYP3A4
SCHEMBL22208636 0.81 NOTUM (0.42) NOTUMCFTRCYP3A4ACHEALDH1A1
SCHEMBL25181444 0.77 KMT2A (0.40) NOTUMCFTRKMT2ANPC1ALDH1A1
SCHEMBL30271454 0.77 KMT2A (0.40) NOTUMCFTRKMT2ANPC1ALDH1A1
SCHEMBL25184371 0.75 HDAC4 (0.38) ALDH1A1L3MBTL1LMNATAS2R14

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
EP-4132917-B1 SUBSTITUTED ISOPHTALIC ACID DIAMIDES BAYER AG (DE) 2024-01-24 EP disclosed
US-20230150953-A1 SUBSTITUTED ISOPHTHALIC ACID DIAMIDES BAYER AKTIENGESELLSCHAFT (DE) 2023-05-18 US disclosed
CN-115884967-A Substituted isophthalic acid diamides 拜耳公司 2023-03-31 CN disclosed
EP-4132917-A1 SUBSTITUTED ISOPHTHALIC ACID DIAMIDES Bayer Aktiengesellschaft (DE) 2023-02-15 EP 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-20230150953-A1 SUBSTITUTED ISOPHTHALIC ACID DIAMIDES DDT, ZDHHC2, DDAH1 NOTUM 489/4885CFTR 1133/4885MEN1 3475/4885

“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.