SCHEMBL21682973

SCHEMBL21682973

O=C(NCCCCC(c1ccc(F)cc1)c1ccc(F)cc1)Nc1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 10/20 1.00
CASR P41180 1/20 0.64
CNR1 P21554 4/20 0.61
FOLH1 Q04609 2/20 0.57
POLB P06746 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
TP53 P04637 1/20 0.55
MAPT P10636 1/20 0.55

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
SCHEMBL26804101 0.88 SLC6A3 (0.78) SLC6A3CASRFOLH1KMT2A
SCHEMBL26804107 0.84 SLC6A3 (0.82) SLC6A3CASRFOLH1RAB9A
SCHEMBL26804115 0.84 SLC6A3 (0.82) SLC6A3CASRRAB9AKMT2AMAPT
SCHEMBL26804129 0.83 SLC6A3 (0.71) SLC6A3CNR1FOLH1POLBKMT2A
SCHEMBL23902831 0.82 SLC6A3 (1.00) SLC6A3CASR
SCHEMBL26804134 0.81 SLC6A3 (0.78) SLC6A3CASRFOLH1KMT2AMAPT
SCHEMBL26804098 0.81 SLC6A3 (0.85) SLC6A3CASRFOLH1KMT2A
SCHEMBL26804142 0.81 SLC6A3 (0.67) SLC6A3CASRFOLH1
SCHEMBL11048686 0.79 CNR1 (0.70) SLC6A3CASRCNR1RAB9A
SCHEMBL26804104 0.79 SLC6A3 (0.74) SLC6A3CASRKMT2AMAPT

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12338204-B2 Substituted bisphenylalkylurea compounds and methods of treating breast cancer TEXAS TECH UNIVERSITY SYSTEM (US) 2025-06-24 US disclosed
US-20250154098-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER UNIV TEXAS TECH SYSTEM (US) 2025-05-15 US disclosed
US-20230382850-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING INFLAMMATORY CONDITIONS TEXAS TECH UNIVERSITY SYSTEM (US) 2023-11-30 US disclosed
US-20230382850-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING INFLAMMATORY CONDITIONS TEXAS TECH UNIVERSITY SYSTEM (US) 2023-11-30 US disclosed
US-20230382850-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING INFLAMMATORY CONDITIONS TEXAS TECH UNIVERSITY SYSTEM (US) 2023-11-30 US disclosed
US-11225459-B2 Substituted bisphenylalkylurea compounds and methods TEXAS TECH UNIVERSITY SYSTEM (US) 2022-01-18 US disclosed
US-11225459-B2 Substituted bisphenylalkylurea compounds and methods TEXAS TECH UNIVERSITY SYSTEM (US) 2022-01-18 US disclosed
US-20210309607-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER TEXAS TECH UNIVERSITY SYSTEM (US) 2021-10-07 US disclosed
US-20210309607-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER TEXAS TECH UNIVERSITY SYSTEM (US) 2021-10-07 US disclosed
US-20200181069-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS TEXAS TECH UNIVERSITY SYSTEM (US) 2020-06-11 US disclosed
US-20200181069-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS TEXAS TECH UNIVERSITY SYSTEM (US) 2020-06-11 US disclosed
WO-2020033909-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER TEXAS TECH UNIVERSITY SYSTEM (US) 2020-02-13 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 (6 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-12338204-B2 Substituted bisphenylalkylurea compounds and methods of treating breast cancer TP53, ULK1, TFEB SLC6A3 1928/4885CASR 4381/4885CNR1 3119/4885
US-20210309607-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER TP53, ULK1, TFEB SLC6A3 1928/4885CASR 4381/4885CNR1 3119/4885
US-20230382850-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING INFLAMMATORY CONDITIONS TFEB, TP53, BECN1 SLC6A3 2908/4885CASR 4362/4885CNR1 2694/4885
US-11225459-B2 Substituted bisphenylalkylurea compounds and methods HTR3B, HTR3A, HTR3C SLC6A3 4/4885CASR 941/4885CNR1 78/4885
US-20200181069-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS HTR3B, HTR3A, HTR3C SLC6A3 4/4885CASR 941/4885CNR1 78/4885
US-20250154098-A1 SUBSTITUTED BISPHENYLALKYLUREA COMPOUNDS AND METHODS OF TREATING BREAST CANCER TP53, ULK1, TFEB SLC6A3 1928/4885CASR 4381/4885CNR1 3119/4885

“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.