SCHEMBL2990425

SCHEMBL2990425

COc1ccc(F)cc1CC#N

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.43
SLC6A2 P23975 11/20 0.43
SLC6A3 Q01959 11/20 0.43
NTRK1 P04629 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
HTR2A P28223 1/20 0.41
KDM4E B2RXH2 1/20 0.41
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL26622106 0.89 TAAR1 (0.54) SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL27920637 0.87 HDAC3 (0.40) SLC6A4SLC6A2SLC6A3NTRK1ALDH1A1
SCHEMBL2116744 0.85 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3NTRK1MEN1
SCHEMBL11825653 0.81 IDO1 (0.56) HTR2A
SCHEMBL30861233 0.81 IDO1 (0.56) HTR2A
SCHEMBL5479089 0.81 ACHE (0.50) MEN1ALDH1A1POLBHPGDKMT2A
SCHEMBL6911481 0.80 CYP1A2 (0.39) SLC6A4ALDH1A1HPGDHTR2A
SCHEMBL4171690 0.80 KDM4E (0.50) MEN1ALDH1A1POLBKMT2AKDM4E
SCHEMBL4522555 0.80 KDM4E (0.56) ALDH1A1HTR2AKDM4E
SCHEMBL27758118 0.80 SLC6A4 (0.49) SLC6A4SLC6A3MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12351577-B2 Inhibiting cyclic AMP-responsive element-binding protein (CREB) FORMA THERAPEUTICS, INC. (US) 2025-07-08 US disclosed
US-20250188079-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) FORMA THERAPEUTICS, INC. 2025-06-12 US disclosed
WO-2025089147-A1 HERBICIDAL COMPOSITION 株式会社エス・ディー・エス バイオテック 2025-05-01 WO disclosed
WO-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed
CN-111971287-B Macrocyclic compounds as TRK kinase inhibitors 重庆复尚源创医药技术有限公司 2023-06-02 CN disclosed
US-11555042-B2 Macrocyclic compounds as TRK kinases inhibitors FOCHON BIOSCIENCES, LTD. (CN) 2023-01-17 US disclosed
US-20220213089-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) FORMA THERAPEUTICS, INC. 2022-07-07 US disclosed
US-20220213089-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) FORMA THERAPEUTICS, INC. 2022-07-07 US disclosed
WO-2022020247-A1 SMALL MOLECULE CORRECTORS OF MAMMALIAN SLC6A8 FUNCTION JNANA THERAPEUTICS, INC. (US) 2022-01-27 WO disclosed
EP-3937940-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) Forma Therapeutics, Inc. (US) 2022-01-19 EP disclosed
US-7781470-B2 Aminodicarboxylic acid derivatives having pharmaceutical properties BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-24 US disclosed
US-20090203906-A1 NOVEL AMINODICARBOXYLIC ACID DERIVATIVES HAVING PHARMACEUTICAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2009-08-13 US disclosed
US-20090203906-A1 NOVEL AMINODICARBOXYLIC ACID DERIVATIVES HAVING PHARMACEUTICAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2009-08-13 US disclosed
US-20090203906-A1 NOVEL AMINODICARBOXYLIC ACID DERIVATIVES HAVING PHARMACEUTICAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2009-08-13 US disclosed
US-7517896-B2 Aminodicarboxylic acid derivatives having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2009-04-14 US disclosed
US-7517896-B2 Aminodicarboxylic acid derivatives having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2009-04-14 US disclosed
US-7517896-B2 Aminodicarboxylic acid derivatives having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2009-04-14 US disclosed
US-7087644-B1 Derivatives of dicarboxylic acid having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2006-08-08 US disclosed
US-20060094769-A1 Novel aminodicarboxylic acid derivatives having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2006-05-04 US disclosed
EP-1216225-B1 NOVEL DERIVATIVES OF DICARBOXYLIC ACID HAVING PHARMACEUTICAL PROPERTIES BAYER HEALTHCARE AG (DE) 2005-07-06 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 (6 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-20090203906-A1 NOVEL AMINODICARBOXYLIC ACID DERIVATIVES HAVING PHARMACEUTICAL PROPERTIES DDC, AADAT, PTGIS SLC6A4 1575/4885SLC6A2 2554/4885SLC6A3 2930/4885
US-20250188079-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) CREBBP, CREB1, EP300 SLC6A4 4347/4885SLC6A2 4536/4885SLC6A3 4037/4885
US-20060094769-A1 Novel aminodicarboxylic acid derivatives having pharmaceutical properties DDC, AADAT, PTGIS SLC6A4 1575/4885SLC6A2 2554/4885SLC6A3 2930/4885
US-11555042-B2 Macrocyclic compounds as TRK kinases inhibitors PLK2, ERBB3, DMPK SLC6A4 4223/4885SLC6A2 4577/4885SLC6A3 4436/4885
US-12351577-B2 Inhibiting cyclic AMP-responsive element-binding protein (CREB) CREBBP, CREB1, EP300 SLC6A4 4347/4885SLC6A2 4536/4885SLC6A3 4037/4885
US-20220213089-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) CREBBP, CREB1, EP300 SLC6A4 4347/4885SLC6A2 4536/4885SLC6A3 4037/4885

“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.