SCHEMBL21292957

SCHEMBL21292957

COC[C@H](N)Cc1c[nH]c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.70
ADRB1 P08588 1/20 0.65
HTR1A P08908 1/20 0.65
ADRA2A P08913 1/20 0.65
SLC6A2 P23975 1/20 0.65
HTR1D P28221 1/20 0.65
HTR1B P28222 1/20 0.65
HTR2C P28335 1/20 0.65
HTR1E P28566 1/20 0.65
SLC6A4 P31645 1/20 0.65
HTR7 P34969 1/20 0.65
HTR2B P41595 1/20 0.65
HTR6 P50406 1/20 0.65
SLC6A3 Q01959 1/20 0.65
TACR1 P25103 2/20 0.63
KDM4E B2RXH2 2/20 0.55
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
MPO P05164 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
SCHEMBL21292958 1.00 HTR2A (0.70) HTR2AADRB1HTR1AADRA2ASLC6A2
Hydrochloric Acid SCHEMBL4632780 0.98 HTR2A (0.68) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL21292728 0.89 HTR2A (0.56) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL21292725 0.89 HTR2A (0.56) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL20424353 0.88 HTR2A (0.67) HTR2AADRB1HTR1AADRA2ASLC6A2
Trifluoroacetic Acid SCHEMBL21292873 0.88 KDM4E (0.56) HTR2AADRB1HTR1AADRA2ASLC6A2
Trifluoroacetic Acid SCHEMBL21292878 0.88 KDM4E (0.56) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL20430493 0.85 HTR2A (0.71) HTR2AADRB1HTR1AADRA2ASLC6A2
Etryptamine SCHEMBL15281765 0.83 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2
Etryptamine SCHEMBL1172193 0.83 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3759075-B1 COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE FERRO THERAPEUTICS INC (US) 2025-07-23 EP disclosed
US-20230039846-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2023-02-09 US disclosed
US-20230039846-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2023-02-09 US disclosed
CN-112041301-A Compounds having iron death inducing activity and methods of use thereof 费罗治疗公司 2020-12-04 CN disclosed
US-20190263802-A1 COMPOUNDS AND METHOD OF USE MOLECULAR SKIN THERAPEUTICS, INC. 2019-08-29 US disclosed
US-20190263802-A1 COMPOUNDS AND METHOD OF USE MOLECULAR SKIN THERAPEUTICS, INC. 2019-08-29 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 (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-20230039846-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 HTR2A 3134/4885ADRB1 4766/4885HTR1A 4288/4885
US-20190263802-A1 COMPOUNDS AND METHOD OF USE AIFM2, GPX4, GPX1 HTR2A 3059/4885ADRB1 4708/4885HTR1A 4154/4885

“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.