SCHEMBL5232154

SCHEMBL5232154

Cc1c(F)ccc(C=O)c1C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.43
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
KCNJ1 P48048 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL4353272 0.84 ALDH1A1 (0.50) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL4293546 0.84 ERN1 (0.42) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL584614 0.84 ERN1 (0.42) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL5643995 0.80 ERN1 (0.59) ERN1
SCHEMBL21121085 0.80 TDP1 (0.42) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL23065826 0.80 ERN1 (0.39) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL9712525 0.80 TDP1 (0.42) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL16415856 0.80 ERN1 (0.39) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL10290090 0.80 ERN1 (0.39) ERN1ALDH1A1TSHRKCNJ1TDP1
SCHEMBL19948618 0.80 ERN1 (0.39) ERN1ALDH1A1TSHRKCNJ1TDP1

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118434417-A Cyclic sulfonamide ribonucleotide reductase (RNR) inhibitors and uses thereof 无界生物公司 2024-08-02 CN disclosed
CN-115583899-B Preparation method of quantum dot catalytic amino butyronitrile compound 浙江理工大学 2023-11-21 CN disclosed
CN-115583899-A Preparation method of quantum dot catalyzed aminobutyronitrile compound 浙江理工大学 2023-01-10 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-10889555-B2 Sulfonamide compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-01-12 US disclosed
US-20200405697-A1 Antitumor Agent TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-12-31 US disclosed
US-20200399235-A1 Sulfonamide Compound or Salt Thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-12-24 US disclosed
EP-3718545-A1 ANTITUMOR AGENT Taiho Pharmaceutical Co., Ltd. (JP) 2020-10-07 EP disclosed
US-20200157066-A1 Sulfonamide Compound or Salt Thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-05-21 US disclosed
EP-3466934-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2019-04-10 EP disclosed
EP-1313691-A2 FLUORINATED AND CHLORINATED BENZALDEHYDES Milliken & Company (US) 2003-05-28 EP disclosed
EP-1313690-A1 METHOD OF PRODUCING FLUORINATED AND CHLORINATED BENZALDEHYDES AND COMPOSITIONS THEREOF Milliken & Company (US) 2003-05-28 EP disclosed
US-6548581-B2 Radiation transparent polyolefin MILLIKEN & COMPANY 2003-04-15 US disclosed
US-20030013786-A1 Novel asymmetric halogen-alkyl alditol derivatives as nucleators and clarifiers for polyolefins, and polyolefin plastic compositions containing same MILLIKEN & COMPANY 2003-01-16 US disclosed
US-20020062034-A1 Novel fluorinated and alkylated alditol derivatives and compositions and polyolefin articles containing same MILLIKEN &COMPANY 2002-05-23 US disclosed
WO-2002020452-A2 NOVEL FLUORINATED AND CHLORINATED BENZALDEHYDES MILLIKEN & COMPANY (US) 2002-03-14 WO disclosed
WO-2002020447-A1 METHOD OF PRODUCING FLUORINATED AND CHLORINATED BENZALDEHYDES AND COMPOSITIONS THEREOF MILLIKEN & COMPANY (US) 2002-03-14 WO disclosed
WO-2002020528-A2 FLUORINATED AND ALKYLATED ALDITOL DERIVATIVES AND POLYOLEFIN ARTICLES CONTAINING SAME MILLIKEN & COMPANY (US) 2002-03-14 WO disclosed
US-6300525-B1 CONTACTING SUBSTITUTED BENZENE IN CARBON MONOXIDE ATMOSPHERE HAVING SPECIFIED PRESSURE IN PRESENCE OF METAL HALIDE AND HYDROHALIC ACID CATALYST AND AT SPECIFIED TEMPERATURE MILLIKEN & COMPANY 2001-10-09 US disclosed
US-6297405-B1 EFFICIENTLY PRODUCED BENZALDEHYDE CHEMICAL INTERMEDIATE SUBSTITUTED BY ONE HALOGEN AND ALKYL OR CYCLOALKYL GROUPS AT OTHER POSITIONS MILLIKEN & COMPANY 2001-10-02 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 (5 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-20200399235-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 ERN1 225/4885ALDH1A1 1103/4885TSHR 840/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 ERN1 225/4885ALDH1A1 1103/4885TSHR 840/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 ERN1 225/4885ALDH1A1 1103/4885TSHR 840/4885
US-20020062034-A1 Novel fluorinated and alkylated alditol derivatives and compositions and polyolefin articles containing same ALDOA, SORD, DERA ERN1 2583/4885ALDH1A1 110/4885TSHR 4548/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B ERN1 400/4885ALDH1A1 1397/4885TSHR 284/4885

“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.