SCHEMBL23063802

SCHEMBL23063802

COC(=O)c1ccc(-c2ccc(Br)cc2C)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.49
DGAT1 O75907 1/20 0.42
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
TP53 P04637 2/20 0.41
NR4A2 P43354 1/20 0.41
MAPT P10636 1/20 0.41
SLC6A4 P31645 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40

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
SCHEMBL31253108 1.00 SLC6A3 (0.49) SLC6A3DGAT1AKR1C3AKR1C2TP53
SCHEMBL21839189 0.89 SLC6A3 (0.51) SLC6A3DGAT1TP53NR4A2MAPT
SCHEMBL2775281 0.85 CA12 (0.50) SLC6A3AKR1C3AKR1C2SLC6A4KDM4E
SCHEMBL31253063 0.85 AKR1C3 (0.47) DGAT1AKR1C3AKR1C2KDM4E
SCHEMBL23063882 0.85 AKR1C3 (0.47) DGAT1AKR1C3AKR1C2KDM4E
SCHEMBL206342 0.82 DGAT1 (0.59) SLC6A3DGAT1NR4A2MAPTKDM4E
Iodomethane SCHEMBL5739657 0.79 DGAT1 (0.56) SLC6A3DGAT1NR4A2MAPTKDM4E
SCHEMBL10004074 0.78 CYP46A1 (0.49) SLC6A3NR4A2MAPTSLC6A4KDM4E
SCHEMBL187447 0.77 NR4A2 (0.53) SLC6A3NR4A2MAPTKDM4ECYP1A2
SCHEMBL30752935 0.77 NR4A2 (0.53) SLC6A3NR4A2MAPTKDM4ECYP1A2

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-20260125367-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS REMEDY PLAN, INC. (US) 2026-05-07 US disclosed
US-12522587-B2 Cancer treatments targeting cancer stem cells REMEDY PLAN, INC. (US) 2026-01-13 US disclosed
US-20220324842-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS REMEDY PLAN, INC. (US) 2022-10-13 US disclosed
EP-3787612-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS Remedy Plan, Inc. (US) 2021-03-10 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 (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-20260125367-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS MCL1, MALT1, BCL6 SLC6A3 2447/4885DGAT1 1215/4885AKR1C3 526/4885
US-20220324842-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS MCL1, CD47, GLI1 SLC6A3 4517/4885DGAT1 300/4885AKR1C3 1547/4885

“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.