SCHEMBL24105697

SCHEMBL24105697

C=Cc1c(F)cccc1C1OCCO1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.35
HTR2B P41595 2/20 0.35
POLB P06746 1/20 0.35
TAAR1 Q96RJ0 2/20 0.32
CYP2D6 P10635 1/20 0.32
NFE2L2 Q16236 2/20 0.32
IKBKB O14920 1/20 0.31
KDM1A O60341 2/20 0.31
KDM1B Q8NB78 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 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
SCHEMBL9431365 0.83 POLB (0.35) HTR2CHTR2BPOLBTAAR1CYP2D6
SCHEMBL24105706 0.80 POLB (0.33) HTR2CHTR2BPOLBTAAR1CYP2D6
SCHEMBL24132563 0.80 NFE2L2 (0.33) HTR2CHTR2BPOLBTAAR1CYP2D6
SCHEMBL24105721 0.76
SCHEMBL5094518 0.76 HTR2C (0.51) HTR2CHTR2BTAAR1CYP2D6KDM1A
SCHEMBL30515523 0.76 HTR2C (0.51) HTR2CHTR2BTAAR1CYP2D6KDM1A
SCHEMBL8251752 0.75 KDM1A (0.47) HTR2CHTR2BKDM1AKDM1B
SCHEMBL14653946 0.73 CYP2D6 (0.47) HTR2CHTR2BTAAR1CYP2D6KDM1A
SCHEMBL24105771 0.73 HTR2C (0.38) HTR2CHTR2BTAAR1CYP2D6KDM1A
SCHEMBL193995 0.72 NFE2L2 (0.46) POLBNFE2L2IKBKB

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115836076-B Compounds as CAV1.2 activators 诺华股份有限公司 2025-04-25 CN disclosed
CN-115698017-B Methyl 2-methyl-5-oxo-1, 4,5, 7-tetrahydrofurano [3,4-b ] pyridine-3-carboxylate compounds as CAV1.2 activators 诺华股份有限公司 2024-09-24 CN disclosed
EP-4165047-A1 METHYL 2-(FLUOROMETHYL)-5-OXO-4-PHENYL-4,5,6,7-TETRAHYDRO-1H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLATES AND METHYL 2-(FLUOROMETHYL)-5-OXO-4-PHENYL-1,4,5,7-TETRAHYDROFURO[3,4-B]PYRIDINE-3-CARBOXYLATES AS CAV1.2 ACTIVATORS Novartis AG (CH) 2023-04-19 EP disclosed
CN-115836076-A Methyl 2- (fluoromethyl) -5-oxo-4-phenyl-4,5,6,7-tetrahydro-1H-cyclopenta [ B ] pyridine-3-carboxylate and methyl 2- (fluoromethyl) -5-oxo-4-phenyl-1,4,5,7-tetrahydrofuro [3,4-B ] pyridine-3-carboxylate as CAV1.2 activators 诺华股份有限公司 2023-03-21 CN disclosed
CN-115698017-A Methyl 2-methyl-5-oxo-1, 4,5, 7-tetrahydrofuro [3,4-b ] pyridine-3-carboxylate compounds as CAV1.2 activators 诺华股份有限公司 2023-02-03 CN disclosed
WO-2021255608-A1 METHYL 2-METHYL-5-OXO-1,4,5,7-TETRADHYDROFURO[3,4- B]PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CAV1.2 ACTIVATORS NOVARTIS AG (CH) 2021-12-23 WO disclosed
WO-2021253180-A1 METHYL (R) -2- (FLUOROMETHYL) -5-OXO-4-PHENYL-4, 5, 6, 7-TETRAHYDRO-1H-CYCLOPENTA [B] PYRIDINE-3-CARBOXYLATE AND METHYL (R) -2- (FLUOROMETHYL) -5-OXO-4-PHENYL-1, 4, 5, 7-TETRAHYDROFURO [3, 4-B] PYRIDINE-3-CARBOXYLATE AS CAV1.2 ACTIVATORS NOVARTIS AG (CH) 2021-12-23 WO disclosed
US-20210395261-A1 METHYL (R)-2-(FLUOROMETHYL)-5-OXO-4-PHENYL-4,5,6,7-TETRAHYDRO-1H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLATE AND METHYL (R)-2-(FLUOROMETHYL)-5-OXO-4-PHENYL-1,4,5,7-TETRAHYDROFURO[3,4-B]PYRIDINE-3-CARBOXYLATE AS CAV1.2 ACTIVATORS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2021-12-23 US disclosed
WO-2021255607-A1 METHYL 2-(FLUOROMETHYL)-5-OXO-4-PHENYL-4,5,6,7-TETRAHYDRO-1H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLATES AND METHYL 2-(FLUOROMETHYL)-5-OXO-4-PHENYL-1,4,5,7-TETRAHYDROFURO[3,4-B]PYRIDINE-3-CARBOXYLATES AS CAV1.2 ACTIVATORS NOVARTIS AG (CH) 2021-12-23 WO disclosed
US-20210387995-A1 METHYL 2-METHYL-5-OXO-1,4,5,7-TETRADHYDROFURO[3,4-b]PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CAV1.2 ACTIVATORS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2021-12-16 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-20210395261-A1 METHYL (R)-2-(FLUOROMETHYL)-5-OXO-4-PHENYL-4,5,6,7-TETRAHYDRO-1H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLATE AND METHYL (R)-2-(FLUOROMETHYL)-5-OXO-4-PHENYL-1,4,5,7-TETRAHYDROFURO[3,4-B]PYRIDINE-3-CARBOXYLATE AS CAV1.2 ACTIVATORS CACNA1D, CACNA1B, CACNA1S HTR2C 134/4885HTR2B 113/4885POLB 3208/4885
US-20210387995-A1 METHYL 2-METHYL-5-OXO-1,4,5,7-TETRADHYDROFURO[3,4-b]PYRIDINE-3-CARBOXYLATE COMPOUNDS AS CAV1.2 ACTIVATORS CACNA1D, CACNA1I, CACNA1S HTR2C 287/4885HTR2B 333/4885POLB 3299/4885

“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.