SCHEMBL25259286

SCHEMBL25259286

Cc1ccc(S(=O)(=O)NC(C)(C)Cn2ccc3c(F)c(F)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RECQL P46063 1/20 0.40
ATM Q13315 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
ALPG P10696 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.38
CYP24A1 Q07973 1/20 0.36
DUT P33316 1/20 0.35

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
SCHEMBL25303265 0.76 RXFP1 (0.46) KMT2AMEN1RAB9AALDH1A1L3MBTL1
SCHEMBL30404969 0.76 RXFP1 (0.46) KMT2AMEN1RAB9AALDH1A1L3MBTL1
SCHEMBL24110227 0.76 HTR2A (0.38) KDM4E
SCHEMBL25257851 0.74 DUT (0.45) KMT2AMEN1RAB9AALDH1A1L3MBTL1
SCHEMBL24110215 0.70 HTR2A (0.42) KDM4E
SCHEMBL7765161 0.68 ALDH1A1 (0.55) TDP1KMT2AMEN1RAB9ATSHR
SCHEMBL24110240 0.68 HTR2C (0.38)
SCHEMBL25818087 0.67 NR3C1 (0.35) KDM4E
SCHEMBL13500312 0.67 PARG (0.56) TDP1KMT2AMEN1RAB9ATSHR
SCHEMBL10282879 0.66 ALDH1A1 (0.56) KMT2AMEN1RAB9AALDH1A1L3MBTL1

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
CN-116507625-A Isochromic amine nerve plasticizer and application thereof 德力克斯疗法有限公司 2023-07-28 CN disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
EP-4165049-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF Delix Therapeutics, Inc. (US) 2023-04-19 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT TDP1 393/4885KMT2A 1200/4885MEN1 3118/4885

“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.