SCHEMBL4100216

SCHEMBL4100216

CC(C)(N)Cc1c[nH]c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
CYP3A4 P08684 3/20 0.58
MAPT P10636 2/20 0.58
AHR P35869 1/20 0.58
GPR84 Q9NQS5 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
HTR2A P28223 5/20 0.56
HTR6 P50406 3/20 0.56
HTR2C P28335 3/20 0.56
HTR1D P28221 2/20 0.56
HTR1B P28222 2/20 0.56
HTR7 P34969 2/20 0.56
CYP2D6 P10635 2/20 0.56
MPO P05164 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2A6 P11509 1/20 0.56
NFKB1 P19838 1/20 0.56
CTSK P43235 1/20 0.56
CYP2A13 Q16696 1/20 0.56

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
SCHEMBL30354035 1.00 MEN1 (0.58) MEN1KMT2ACYP3A4MAPTAHR
Hydrochloric Acid SCHEMBL27797436 0.98 PMP22 (0.57) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL27452680 0.89 MEN1 (0.58) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL73842 0.85 MEN1 (0.62) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL16366298 0.85 MEN1 (0.53) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL11821215 0.85 MEN1 (0.53) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL3944970 0.83 MEN1 (0.51) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL11816093 0.83 MEN1 (0.55) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL18647213 0.82 MEN1 (0.50) MEN1KMT2ACYP3A4MAPTAHR
SCHEMBL11818699 0.82 HTR2A (0.50) MEN1KMT2ACYP3A4MAPTAHR

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 99 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024804-A1 PSILOCYBIN COMPOSITIONS TURTLE BEAR HOLDINGS LLC (US) 2023-01-26 US claimed
EP-0251938-B1 STEREOSPECIFIC PROCESS FOR THE SYNTHESIS OF INDOLE DERIVATIVES SANOFI (FR) 1991-11-06 EP claimed
US-4977274-A REACTING PROTECTED GLYCIDYLOXYINDOLE WITH AMINE, DEPROTECTING SANOFI (FR) 1990-12-11 US claimed
EP-0338352-A2 Salicylic acid derivatives MERCK PATENT GmbH (DE) 1989-10-25 EP claimed
EP-0228356-B1 HYDROXY-4-INDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE SANOFI S.A. (FR) 1989-08-02 EP claimed
US-4806655-A Process for the stereospecific synthesis of indole derivatives SOCIETE ANONYME: SANOFI (FR) 1989-02-21 US claimed
CN-118234491-A Hallucinogen-fatty acid combinations 明德赛特制药公司 2024-06-21 CN disclosed
US-11896587-B2 Tryptamine compositions for enhancing neurite outgrowth TURTLE BEAR HOLDINGS, LLP (US) 2024-02-13 US disclosed
US-20230218603-A1 PSILOCYBIN COMPOSITIONS TURTLE BEAR HOLDINGS LLC (US) 2023-07-13 US disclosed
CN-112679495-B Estrogen receptor modulators 里科瑞尔姆IP控股有限责任公司 2023-03-28 CN disclosed
US-20230039846-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2023-02-09 US disclosed
US-11452712-B2 Methods and compositions involving (S)-bucindolol ARCA BIOPHARMA INC. (US) 2022-09-27 US disclosed
CN-113717170-A Estrogen receptor modulators 里科瑞尔姆IP控股有限责任公司 2021-11-30 CN disclosed
US-4522824-A ADRENERGIC BLOCKING AGENTS SANOFI (FR) 1985-06-11 US disclosed
US-4517188-A HYPOTENSIVE AGENTS, VASODILATORS, ADRENERGIC BETA BLOCKERS MEAD JOHNSON & COMPANY (US) 1985-05-14 US disclosed
US-4495352-A HYPOTENSIVE AGENTS; VASODILATION; ADRENERGIC BLOCKING ACTION MEAD JOHNSON & COMPANY (US) 1985-01-22 US disclosed
EP-0130878-A1 Hexahydroindolonaphthyridine derivatives, their preparation and therapeutic use SYNTHELABO (FR) 1985-01-09 EP disclosed
US-4314943-A ANTIHYPERTENSIVE AGENTS; VASODILATORS MEAD JOHNSON & COMPANY (US) 1982-02-09 US disclosed
US-4234595-A HYPOTENSIVE AGENTS; ADRENERGIC BLOCKING AGENTS; VASODILATION MEAD JOHNSON & COMPANY (US) 1980-11-18 US disclosed
US-3947584-A Novel indolyl alkyl amines, method of producing same, and their use as anorectic agents SIEGFRIED AKTIENGESELLSCHAFT (CH) 1976-03-30 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 (5 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-11896587-B2 Tryptamine compositions for enhancing neurite outgrowth HTR1B, HTR6, BDNF MEN1 1443/4885KMT2A 2403/4885CYP3A4 2427/4885
US-20230039846-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 MEN1 1772/4885KMT2A 2510/4885CYP3A4 3860/4885
US-20230218603-A1 PSILOCYBIN COMPOSITIONS NES, PNMT, GAP43 MEN1 525/4885KMT2A 3730/4885CYP3A4 3329/4885
US-20230024804-A1 PSILOCYBIN COMPOSITIONS NES, PNMT, GAP43 MEN1 525/4885KMT2A 3730/4885CYP3A4 3329/4885
US-11452712-B2 Methods and compositions involving (S)-bucindolol ADRB3, ADRB2, ADRB1 MEN1 3096/4885KMT2A 4746/4885CYP3A4 118/4885

“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.