SCHEMBL650735

SCHEMBL650735

Nn1[c]cc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.34
CDK4 P11802 3/20 0.32
CCND1 P24385 3/20 0.32
CYP2A6 P11509 1/20 0.32
ALOX12 P18054 1/20 0.32
BIRC5 O15392 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
THPO P40225 1/20 0.31
CYP4Z1 Q86W10 1/20 0.31
NOTUM Q6P988 1/20 0.31
CA12 O43570 2/20 0.30
CA9 Q16790 2/20 0.30
BRD4 O60885 1/20 0.30
BRPF1 P55201 1/20 0.30
KAT2B Q92831 1/20 0.30

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
SCHEMBL718221 0.73 KDM4E (0.37) CDK4CCND1ALDH1A1KDM4EATM
SCHEMBL3849038 0.71 CA12 (0.34) CDK4CCND1CYP2A6ALOX12ALDH1A1
SCHEMBL127255 0.71 DAO (0.35) CDK4CCND1CYP2A6ALOX12ALDH1A1
SCHEMBL2073630 0.71 CDK4 (0.32) NOS2CDK4CCND1CYP2A6ALOX12
SCHEMBL570353 0.71 CDK4 (0.32) CDK4CCND1CYP2A6ALOX12ALDH1A1
SCHEMBL137023 0.71 CA12 (0.39) CDK4CCND1CYP2A6ALOX12ALDH1A1
SCHEMBL2073401 0.71 CDK4 (0.32) CDK4CCND1CYP2A6ALOX12BIRC5
SCHEMBL7781747 0.67 HTR3A (0.43) CYP2A6ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL2071020 0.67 SMN1; SMN2 (0.38) CYP2A6ALDH1A1MAPTCYP1A2CA12
SCHEMBL15271285 0.67 RECQL (0.35) CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9725474-B2 Modified nucleic acid TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-08 US claimed
WO-2013071079-A1 LIN28/LET-7 CRYSTAL STRUCTURES, PURIFICATION PROTOCOLS, AND MOLECULAR PROBES SUITABLE FOR SCREENING ASSAYS AND THERAPEUTICS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-05-16 WO claimed
EP-4392140-A1 IN VITRO TRANSCRIPTION TECHNOLOGIES BioNTech SE (DE) 2024-07-03 EP disclosed
US-12018260-B2 Tunable Reversir™ compounds ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-25 US disclosed
CN-115038790-B Synthesis of 3' -RNA oligonucleotides 阿尔尼拉姆医药品有限公司 2024-06-21 CN disclosed
US-20240200061-A1 TRANSTHYRETIN (TTR) iRNA COMPOSITIONS AND METHODS OF USE THEREOF FOR TREATING OR PREVENTING TTR-ASSOCIATED OCULAR DISEASES ALNYLAM PHARMACEUTICALS, INC. 2024-06-20 US disclosed
WO-2024123993-A1 SELECTIVE APOPTOSIS-INDUCING METHODS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-06-13 WO disclosed
EP-4380576-A2 COMPOSITIONS AND METHODS FOR TARGETED RNA DELIVERY Verve Therapeutics, Inc. (US) 2024-06-12 EP disclosed
US-12005074-B2 Extrahepatic delivery ALNYLAM PHARMACEUTICALS, INC. (US) 2024-06-11 US disclosed
US-20240175020-A1 COMPOSITIONS OF MODIFIED TREMS AND USES THEREOF FLAGSHIP PIONEERING INNOVATIONS VI, LLC 2024-05-30 US disclosed
US-20240175028-A1 DOSING OF siRNA COMPOUNDS TO THE CISTERNA MAGNA ALNYLAM PHARMACEUTICALS, INC (US) 2024-05-30 US disclosed
WO-2006037996-A1 NOVEL CYCLIC AND ACYCLIC PROPENONES FOR TREATING CNS DISORDERS MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-13 WO disclosed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US disclosed
US-20060035254-A1 Oligonucleotides comprising a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS, INC. (US) 2006-02-16 US disclosed
EP-0483881-B1 3-Amidoindolyl derivatives MERRELL PHARMA INC (US) 1998-01-21 EP disclosed
US-5703107-A CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-12-30 US disclosed
US-5675018-A 3-amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-10-07 US disclosed
US-5491153-A 3-amidoindolyl derivative MERRELL DOW PHARMACEUTICALS INC. (US) 1996-02-13 US disclosed
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US disclosed
EP-0483881-A1 3-Amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-05-06 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 (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-12005074-B2 Extrahepatic delivery RNASE1, SLC10A1, FABP1 NOS2 3736/4885CDK4 4694/4885CCND1 4608/4885
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 NOS2 3530/4885CDK4 1953/4885CCND1 3590/4885
US-12018260-B2 Tunable Reversir™ compounds SNRPE, PLK1, LDLR NOS2 3590/4885CDK4 1576/4885CCND1 2788/4885
US-20240175028-A1 DOSING OF siRNA COMPOUNDS TO THE CISTERNA MAGNA ELAVL1, HNRNPA1, ELAVL3 NOS2 3088/4885CDK4 4695/4885CCND1 4258/4885
US-20060035254-A1 Oligonucleotides comprising a modified or non-natural nucleobase NT5C3B, DERA, DUT NOS2 2005/4885CDK4 2764/4885CCND1 3681/4885

“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.