SCHEMBL23326095

SCHEMBL23326095

COc1cc(Br)c(O)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ HTR2A P28223 7/20 0.44
▸ HTR2C P28335 4/20 0.44
▸ CYP1A1 P04798 1/20 0.43
▸ CYP1B1 Q16678 1/20 0.43
▸ ALOX5 P09917 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ NOTUM Q6P988 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HTR2B P41595 3/20 0.38
▸ LCK P06239 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ ERN1 O75460 1/20 0.38
▸ APP P05067 1/20 0.37
▸ HTR1A P08908 1/20 0.36

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
SCHEMBL23326154 0.82 HTR2A (0.51) HTR2AHTR2CPOLBL3MBTL1HTR2B
SCHEMBL29775360 0.82 HTR2A (0.51) HTR2AHTR2CPOLBL3MBTL1HTR2B
SCHEMBL19612115 0.82 HTR2A (0.47) LMNAHTR2AHTR2CALOX5PTGS2
SCHEMBL23326301 0.81 TSHR (0.42) LMNACYP3A4HPGDHTR2ANPSR1
SCHEMBL19627259 0.79 HTR2A (0.45) HPGDHTR2AHTR2CNOTUMPOLB
SCHEMBL19407799 0.78 L3MBTL1 (0.52) HTR2AHTR2CNOTUMPOLBL3MBTL1
SCHEMBL29560669 0.78 LCK (0.52) ALOX15ALOX5PTGS2POLBL3MBTL1
SCHEMBL13993593 0.78 LCK (0.52) ALOX15ALOX5PTGS2POLBL3MBTL1
SCHEMBL20756625 0.77 HTR2A (0.62) LMNATP53CYP3A4HPGDALOX15
SCHEMBL17169780 0.76 ALOX5 (0.48) HPGDALOX15ALOX5PTGS2POLB

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-20240208903-A1 ACID ADDITION SALTS OF (S)-3-(2,5-DIMETHOXY-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE AND (S)-3-(2-METHOXY-5-(METHYLTHIO)-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE, SPECIFIC POLYMORPHS THEREOF AND METHODS FOR THEIR MANUFACTURE Lophora ApS (DK) 2024-06-27 — — US disclosed
EP-4334288-A1 ACID ADDITION SALTS OF (S)-3-(2,5-DIMETHOXY-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE AND (S)-3-(2-METHOXY-5-(METHYLTHIO)-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE, SPECIFIC POLYMORPHS THEREOF AND METHODS FOR THEIR MANUFACTURE Lophora ApS (DK) 2024-03-13 — — EP disclosed
CN-114761083-B 5-HT for treating depression 2A Agonists 罗福拉公司 2024-02-13 — — CN disclosed
CN-117222623-A Acid addition salts of (S) -3- (2, 5-dimethoxy-4- (trifluoromethyl) phenyl) piperidine and (S) -3- (2-methoxy-5- (methylthio) -4- (trifluoromethyl) phenyl) piperidine, specific polymorphs thereof and processes for preparing the same 罗弗拉有限公司 2023-12-12 — — CN disclosed
EP-3962601-B1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2023-05-31 — — EP disclosed
US-11642336-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2023-05-09 — — US disclosed
US-11633390-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2023-04-25 — — US disclosed
CN-114761083-A 5-HT for the treatment of depression2AAgonists 罗福拉公司 2022-07-15 — — CN disclosed
US-20220062257-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2022-03-03 — — US disclosed
US-11246860-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2022-02-15 — — US disclosed
US-20210330658-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2021-10-28 — — US disclosed
US-20210137908-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2021-05-13 — — 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 (7 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-20210330658-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885
US-20220062257-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885
US-20240208903-A1 ACID ADDITION SALTS OF (S)-3-(2,5-DIMETHOXY-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE AND (S)-3-(2-METHOXY-5-(METHYLTHIO)-4-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE, SPECIFIC POLYMORPHS THEREOF AND METHODS FOR THEIR MANUFACTURE CYP2D6, CYP3A5, CYP2B6 LMNA 2525/4885TP53 3601/4885CYP3A4 4/4885
US-11642336-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885
US-20210137908-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885
US-11633390-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885
US-11246860-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A LMNA 3797/4885TP53 4882/4885CYP3A4 1541/4885

“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.

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