SCHEMBL583541

SCHEMBL583541

NC(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.64
SLC6A2 P23975 1/20 0.64
SMN1; SMN2 Q16637 2/20 0.56
HIF1A Q16665 1/20 0.56
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
LOXL2 Q9Y4K0 2/20 0.48
LMNA P02545 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAOB P27338 3/20 0.46
MAOA P21397 2/20 0.46
CALM1 P0DP23 1/20 0.45
CYP2A6 P11509 1/20 0.43
HTR2A P28223 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
FDPS P14324 1/20 0.43
KIF11 P52732 1/20 0.42
IDO1 P14902 3/20 0.42

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
Bromide SCHEMBL5087806 0.97 TAAR1 (0.61) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
Water SCHEMBL8366271 0.97 TAAR1 (0.61) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
Hydrochloric Acid SCHEMBL5087218 0.97 TAAR1 (0.61) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
Iodide SCHEMBL5092148 0.97 TAAR1 (0.61) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
SCHEMBL29342 0.87 TAAR1 (0.56) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
SCHEMBL10503241 0.85 TAAR1 (0.67) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
SCHEMBL17714576 0.85 TAAR1 (0.54) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
SCHEMBL2351133 0.85 KDM4E (0.57) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
Hydrochloric Acid SCHEMBL11047140 0.85 TAAR1 (0.54) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2
SCHEMBL465335 0.85 KDM4E (0.57) TAAR1SLC6A2SMN1; SMN2HIF1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3362494-B1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS EVONIK OPERATIONS GMBH (DE) 2023-08-16 EP claimed
CN-106795261-B Polyurethane catalysts based on salts of sulfur 赢创运营有限公司 2020-04-21 CN claimed
US-10570245-B2 Polyurethane catalysts from sulfur based salts EVONIK OPERATIONS GMBH (DE) 2020-02-25 US claimed
US-10472459-B2 Polyurethane catalysts from a sulfur based salts EVONIK DEGUSSA GMBH (DE) 2019-11-12 US claimed
EP-3362494-A1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS Evonik Degussa GmbH (DE) 2018-08-22 EP claimed
EP-3207071-A1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS Evonik Degussa GmbH (DE) 2017-08-23 EP claimed
WO-2017065832-A1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS AIR PRODUCTS AND CHEMICALS, INC. (US) 2017-04-20 WO claimed
US-20160229945-A1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-08-11 US claimed
WO-2016061068-A1 POLYURETHANE CATALYSTS FROM SULFUR BASED SALTS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-04-21 WO claimed
US-20160102169-A1 Polyurethane Catalysts from Sulfur Based Salts AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-04-14 US claimed
US-4312818-A CATALYZED REACTION OF A PHENOL WITH A PHOSPHORUS HALIDE CIBA-GEIGY CORPORATION (US) 1982-01-26 US claimed
EP-4637760-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE Imago Biosciences Inc. (US) 2025-10-29 EP disclosed
WO-2024215862-A2 HETEROCYCLIC COMPOUNDS AS NRAS INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-10-17 WO disclosed
EP-4419504-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE Imago Biosciences Inc. (US) 2024-08-28 EP disclosed
US-12036223-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy THE PENN STATE RESEARCH FOUNDATION (US) 2024-07-16 US disclosed
WO-2003020688-A1 SELECTIVE PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-03-13 WO disclosed
WO-2002057286-A2 9-AMINO ERYTHROMYCIN DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ABBOTT LABORATORIES (US) 2002-07-25 WO disclosed
WO-2002018321-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2002-03-07 WO disclosed
US-5181988-A Hypophosphorous acid or salt ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1993-01-26 US disclosed
EP-0199997-A2 Process for preparing diaryl-pentaerythritol ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1986-11-05 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-12036223-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy TSG101, TNFSF10, BCL2L10 TAAR1 3276/4885SLC6A2 3773/4885SMN1; SMN2 1225/4885

“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.