SCHEMBL7826338

SCHEMBL7826338

N#CCCN1C(=O)CCC1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.39
P2RX7 Q99572 3/20 0.36
ALDH1A1 P00352 1/20 0.36
RORC P51449 7/20 0.35
CYP3A4 P08684 3/20 0.35
CYP2C8 P10632 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2C19 P33261 1/20 0.34
TSHR P16473 1/20 0.34
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL10754807 1.00 ACE (0.39) ACEP2RX7ALDH1A1RORCCYP3A4
SCHEMBL20077497 0.89 RORC (0.35) P2RX7ALDH1A1RORCCYP3A4CYP2C8
SCHEMBL6706546 0.83 ACE (0.41) ACEP2RX7ALDH1A1MEN1POLB
SCHEMBL21432045 0.82 P2RX7 (0.38) ACEP2RX7ALDH1A1RORCCYP3A4
SCHEMBL8761596 0.78 P2RX7 (0.46) ACEP2RX7ALDH1A1MEN1POLB
Hydrochloric Acid SCHEMBL8895919 0.77 ACE (0.41) ACEP2RX7ALDH1A1MEN1POLB
SCHEMBL29833530 0.75 MEN1 (0.57) ACEP2RX7ALDH1A1MEN1POLB
SCHEMBL8762017 0.75 MEN1 (0.57) ACEP2RX7ALDH1A1MEN1POLB
SCHEMBL8613094 0.75 ACE (0.40) ACEP2RX7ALDH1A1MEN1POLB
SCHEMBL24749823 0.74 ACE (0.42) ACEP2RX7ALDH1A1MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4631573-A2 TEAD INHIBITORS Orion Corporation (FI) 2025-10-15 EP disclosed
EP-4323338-B1 TEAD INHIBITORS ORION CORP (FI) 2025-10-08 EP disclosed
US-10934286-B2 Heterocyclic sulfones as ROR gamma modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-02 US disclosed
US-20190300523-A1 HETEROCYCLIC SULFONES AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2019-10-03 US disclosed
CN-110278711-A TRICYCLIC SULFONES AS ROR GAMMA MODULATORS 百时美施贵宝公司 2019-09-24 CN disclosed
CN-110049985-A HETEROCYCLIC SULFONES AS ROR GAMMA MODULATORS 百时美施贵宝公司 2019-07-23 CN disclosed
WO-2018089402-A1 TRICYCLIC SULFONES AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 WO disclosed
WO-2018071620-A1 HETEROCYCLIC SULFONES AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-19 WO disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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 (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-20190300523-A1 HETEROCYCLIC SULFONES AS ROR GAMMA MODULATORS RORC, RORB, RORA ACE 3546/4885P2RX7 814/4885ALDH1A1 788/4885
US-10934286-B2 Heterocyclic sulfones as ROR gamma modulators RORC, RORB, RORA ACE 3546/4885P2RX7 814/4885ALDH1A1 788/4885

“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.