SCHEMBL3679901

SCHEMBL3679901

CC(C)CCNC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
GAA P10253 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 3/20 0.45
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
EPHX1 P07099 1/20 0.40
RAD52 P43351 1/20 0.40
SMYD3 Q9H7B4 1/20 0.39
CXCR4 P61073 2/20 0.39
CXCL12 P48061 1/20 0.39
HTT P42858 1/20 0.37
CYP2D6 P10635 2/20 0.37
SOS1 Q07889 1/20 0.37
ANPEP P15144 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
SCHEMBL7777018 1.00 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL7776906 0.98 ALDH1A1 (0.53) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL11890328 0.93 ALDH1A1 (0.48) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL4668397 0.88
SCHEMBL7058555 0.87 CXCR4 (0.44) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL22507525 0.85 CXCR4 (0.43) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL11932559 0.84 ALDH1A1 (0.46) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL11055203 0.84 CXCR4 (0.42) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL28100087 0.84 CXCR4 (0.42) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL24437738 0.83 ALDH1A1 (0.44) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630661-B2 Additives useful in 3D printing technologies Evonik Operations GmbII (DE) 2026-05-19 US claimed
US-20230120872-A1 ADDITIVES USEFUL IN 3D PRINTING TECHNOLOGIES EVONIK OPERATIONS GMBH (DE) 2023-04-20 US claimed
EP-4166332-A1 ADDITIVES USEFUL IN 3D PRINTING TECHNOLOGIES Evonik Operations GmbH (DE) 2023-04-19 EP claimed
CN-115960328-A Additives for 3D printing techniques 赢创运营有限公司 2023-04-14 CN claimed
US-12630661-B2 Additives useful in 3D printing technologies Evonik Operations GmbII (DE) 2026-05-19 US disclosed
EP-4245756-A1 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF Gilead Sciences, Inc. (US) 2023-09-20 EP disclosed
EP-3853219-B1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINE HYDRAZIDES BAYER AG (DE) 2023-07-12 EP disclosed
US-20230120872-A1 ADDITIVES USEFUL IN 3D PRINTING TECHNOLOGIES EVONIK OPERATIONS GMBH (DE) 2023-04-20 US disclosed
EP-4166332-A1 ADDITIVES USEFUL IN 3D PRINTING TECHNOLOGIES Evonik Operations GmbH (DE) 2023-04-19 EP disclosed
CN-115960328-A Additives for 3D printing techniques 赢创运营有限公司 2023-04-14 CN disclosed
WO-2022101453-A1 COMPOUNDS AND METHODS FOR TREATING A CYTOKINE-MEDIATED DISEASE Conservatoire National des Arts et Métiers (FR) 2022-05-19 WO disclosed
US-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
EP-1454958-A1 LACTIC ACID POLYMER COMPOSITION AND MOLDED OBJECT THEREOF NEW JAPAN CHEMICAL CO.,LTD. (JP) 2004-09-08 EP disclosed
EP-0838508-B1 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORP (JP) 2001-08-29 EP disclosed
US-5973076-A MOLDING; CONTROLLING TEMPERATURE IN PRESENCE OF AN AMIDE COMPOUND NEW JAPAN CHEMICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0776933-B1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEM CO LTD (JP) 1999-08-04 EP disclosed
US-5871572-A COLORANT, WATER, A WATER-SOLUBLE ORGANIC SOLVENT, AND PECTIC ACID SEIKO EPSON CORPORATION (JP) 1999-02-16 US disclosed
EP-0838508-A2 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORPORATION (JP) 1998-04-29 EP disclosed
EP-0776933-A1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEMICAL CO.,LTD. (JP) 1997-06-04 EP disclosed
US-4459424-A SECONDARY AMINE, CARBON DISULFIDE, METAL CONTAINING CATALYST AKZONA INCORPORATED (US) 1984-07-10 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-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer IDO1, IDO2, INMT ALDH1A1 263/4885CYP1A2 192/4885CYP2C19 1036/4885
US-12630661-B2 Additives useful in 3D printing technologies HTR3D, HTR3B, HTR3C ALDH1A1 1803/4885CYP1A2 1419/4885CYP2C19 1223/4885

“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.